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4-氯-3,5-二甲基苯酚

11篇引用文献 COA COA
    级别和纯度:
  • ≥99%
有货

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货号 (SKU) 包装规格 是否现货 价格 数量
C109450-25g
 25g 现货 Stock Image
C109450-100g
 100g 现货 Stock Image
C109450-500g
 500g 现货 Stock Image
C109450-2.5kg
 2.5kg 期货 Stock Image
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Anti-infection (2804) Bacterial (5911) Influenza Virus (253) Parasite (1836) Virus (3767) 酚 (517) 非杂环砌块 (8221)
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基本描述

别名 4-氯-3,5-二甲酚 | 氯二甲酚 | 氯二甲苯酚
英文别名 Camel | Caswell No. 218 | Chloroxylenol (USAN:USP:INN:BAN) | CHEBI:34393 | EINECS 201-793-8 | 5-dimethylphenol | 2-Chloro-5-hydroxy-m-xylene | Antiseptic Hand | BRN 1862539 | Desson | Nipacide PX | Pearlescent | Skin Cleanser | Cloroxilenol [INN-Spanish]
规格或纯度 ≥99%
英文名称 4-Chloro-3,5-dimethylphenol
储存温度 -20°C储存
运输条件 超低温冰袋运输
作用类型 抑制剂
产品介绍

Chloroxylenol是一种广谱抗菌剂, 可用于控制细菌，藻类，真菌和病毒。
纯度 ≥99%

产品属性

ALogP 2

关联靶点（人）

PDE5A Tclin Phosphodiesterase 5A (5113 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
EGFR Tclin Epidermal growth factor receptor erbB1 (33727 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
F2 Tclin Thrombin (11687 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
CA2 Tclin Carbonic anhydrase II (17698 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ESR1 Tclin Estrogen receptor alpha (17718 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
HMGCR Tclin HMG-CoA reductase (2475 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
NR3C1 Tclin Glucocorticoid receptor (14987 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
INSR Tclin Insulin receptor (5558 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
PGR Tclin Progesterone receptor (8562 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ADRB2 Tclin Beta-2 adrenergic receptor (11824 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
CHRM2 Tclin Muscarinic acetylcholine receptor M2 (10671 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ADRB1 Tclin Beta-1 adrenergic receptor (6630 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
HTR1A Tclin Serotonin 1a (5-HT1a) receptor (14969 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ADRA2A Tclin Alpha-2a adrenergic receptor (9450 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
AR Tclin Androgen Receptor (11781 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
CHRM1 Tclin Muscarinic acetylcholine receptor M1 (12690 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
VDR Tclin Vitamin D receptor (26531 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ACE Tclin Angiotensin-converting enzyme (1423 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
DRD2 Tclin Dopamine D2 receptor (23596 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
MAOA Tclin Monoamine oxidase A (11911 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
CNR1 Tclin Cannabinoid CB1 receptor (20913 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
DRD1 Tclin Dopamine D1 receptor (9720 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
DRD4 Tchem Dopamine D4 receptor (7907 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ACHE Tclin Acetylcholinesterase (18204 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
PTGS1 Tclin Cyclooxygenase-1 (9233 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLC6A2 Tclin Norepinephrine transporter (10102 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
HRH2 Tclin Histamine H2 receptor (5428 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ADRA1D Tclin Alpha-1d adrenergic receptor (4171 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
HTR1B Tclin Serotonin 1b (5-HT1b) receptor (2801 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
HTR2A Tclin Serotonin 2a (5-HT2a) receptor (14758 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
HTR2C Tclin Serotonin 2c (5-HT2c) receptor (11471 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ADORA1 Tclin Adenosine A1 receptor (17603 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
CALCR Tclin Calcitonin receptor (2215 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLC6A4 Tclin Serotonin transporter (12625 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ADRA1A Tclin Alpha-1a adrenergic receptor (8359 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
PTGS2 Tclin Cyclooxygenase-2 (13999 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
HRH1 Tclin Histamine H1 receptor (7573 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ADRA1B Tclin Alpha-1b adrenergic receptor (2912 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
OPRM1 Tclin Mu opioid receptor (19785 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
DRD3 Tclin Dopamine D3 receptor (14368 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
AVPR1A Tclin Vasopressin V1a receptor (5412 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
OPRD1 Tclin Delta opioid receptor (15096 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
OPRK1 Tclin Kappa opioid receptor (16155 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLC6A3 Tclin Dopamine transporter (10535 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
PTH1R Tclin Parathyroid hormone receptor (47172 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLC18A2 Tclin Synaptic vesicular amine transporter (118 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
KCNH2 Tclin HERG (29587 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
HTR4 Tclin Serotonin 4 (5-HT4) receptor (2068 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
PDE3A Tclin Phosphodiesterase 3A (3309 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ESR2 Tclin Estrogen receptor beta (9272 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID

关联靶点（其它种属）

Agtr2 Angiotensin II type 2 (AT-2) receptor (803 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Mc4r Melanocortin receptor 4 (1205 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Ltc4s Leukotriene C4 synthase (1 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Sigmar1 Sigma opioid receptor (160 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Npy1r Neuropeptide Y receptor type 1 (8 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Cckar Cholecystokinin A receptor (90 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Nos2 Nitric oxide synthase, inducible (3573 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Mapk1 MAP kinase ERK2 (650 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Hdac6 Histone deacetylase 6 (222 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Mmp9 Matrix metalloproteinase 9 (38 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Streptococcus pneumoniae (31063 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Pseudomonas aeruginosa (123386 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Klebsiella pneumoniae (43867 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Staphylococcus aureus (210822 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Staphylococcus epidermidis (22802 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Acinetobacter baumannii (41033 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Escherichia coli (133304 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Enterococcus faecium (13803 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Aspergillus niger (16508 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Enterococcus faecalis (29875 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Plasmodium falciparum (966862 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Rattus norvegicus (775804 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Stenotrophomonas maltophilia (1743 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
rep Replicase polyprotein 1ab (378 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Drosophila (190 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
fba Putative fructose-1,6-bisphosphate aldolase (15559 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
FTL Ferritin light chain (43324 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Glra2 Glycine receptor (1745 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SARS-CoV-2 (38078 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID

作用机制

作用机制 Action Type target ID Target Name Target Type Target Organism Binding Site Name 参考文献

名称和识别符

PubChem SID 504750593
EC号 201-793-8
分子类型 小分子
IIUPAC Name 4-chloro-3,5-dimethylphenol
INCHI 1S/C8H9ClO/c1-5-3-7(10)4-6(2)8(5)9/h3-4,10H,1-2H3
InChi Key OSDLLIBGSJNGJE-UHFFFAOYSA-N
Smiles CC1=CC(=CC(=C1Cl)C)O
Isomeric SMILES CC1=CC(=CC(=C1Cl)C)O
UN Number 3335
分子量 156.61
Beilstein号 1862539
Reaxy-Rn 1862539
Reaxys-RN link address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1862539&ln=

化学和物理性质

溶解性 Soluble in benzene, toluene, glycerin, chloroform, acetone, isopropanol, alcohol, ether, terpenes and in solutions of alkali hydroxides. Slightly soluble in water.
密度 1.183
闪点(℉) 280℉
闪点(℃) 138℃
沸点 246℃
熔点 115°C
分子量 156.610 g/mol
XLogP3 2.000
氢键供体数Hydrogen Bond Donor Count 1
氢键受体数Hydrogen Bond Acceptor Count 1
可旋转键计数Rotatable Bond Count 0
精确质量Exact Mass 156.034 Da
单同位素质量Monoisotopic Mass 156.034 Da
拓扑极表面积Topological Polar Surface Area 20.200 Ų
重原子数Heavy Atom Count 10
形式电荷Formal Charge 0
复杂度Complexity 104.000
同位素原子数Isotope Atom Count 0
定义的原子立体中心计数Defined Atom Stereocenter Count 0
未定义的原子立体中心计数Undefined Atom Stereocenter Count 0
定义的键立体中心计数Defined Bond Stereocenter Count 0
未定义的键立体中心计数Undefined Bond Stereocenter Count 0
所有立体化学键的总数The total count of all stereochemical bonds 0
共价键合单元计数Covalently-Bonded Unit Count 1

安全和危险性（GHS）

象形图 GHS07
信号词 警告
危险声明

H302: 吞食有害

H315: 引起皮肤刺激

H317: 可能引起皮肤过敏反应

H319: 引起严重眼睛刺激
预防措施声明

P261: 避免吸入灰尘/烟雾/气体/雾/蒸汽/喷雾

P264: 处理后要彻底洗手。

P270: 使用本产品时，请勿进食、饮水或吸烟。

P272: 被污染的工作服不允许离开工作场所

P280: 戴防护手套/穿防护服/戴防护眼罩/戴防护面具。

P302+P352: 如皮肤沾染：用水充分清洗。

P305+P351+P338: 如进入眼睛：用水小心冲洗几分钟。如戴隐形眼镜并可方便地取出，取出隐形眼镜。继续冲洗。

P333+P313: 如发生皮肤刺激或皮疹：求医/就诊。

P337+P313: 如仍觉眼刺激：求医/就诊。

P301+P312+P330: 如误吞咽：如感觉不适，呼叫急救中心/医生。漱口
WGK Germany 1
RTECS ZE6850000
Merck Index 2176
个人防护装备 dust mask type N95 (US),Eyeshields,Faceshields,Gloves

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引用文献

1. Tetsuo Yamano,Mitsuru Shimizu,Tsutomu Noda.  (2003-08-21)  Allergenicity evaluation of p-chloro-m-cresol and p-chloro-m-xylenol by non-radioactive murine local lymph-node assay and multiple-dose guinea pig maximization test..  Toxicology,  190  ((3)): (259-266).  [PMID:12927380]
2. Martin Leuwer,Gertrud Haeseler,Hartmut Hecker,Johannes Bufler,Reinhard Dengler,Jeffrey K Aronson.  (2003-12-10)  An improved model for the binding of lidocaine and structurally related local anaesthetics to fast-inactivated voltage-operated sodium channels, showing evidence of cooperativity..  British journal of pharmacology,  141  ((1)): (47-54).  [PMID:14662728]
3. Colin A Graham.  (2004-05-29)  Stridor after ingestion of dettol and domestos..  European journal of emergency medicine : official journal of the European Society for Emergency Medicine,  11  ((1)): (52-54).  [PMID:15167195]
4. S Messager,P A Goddard,P W Dettmar,J-Y Maillard.  (2004-10-12)  Comparison of two in vivo and two ex vivo tests to assess the antibacterial activity of several antiseptics..  The Journal of hospital infection,  58  ((2)): (115-121).  [PMID:15474182]
5. Mirta Beatriz Reynaldo,Mónica Beatriz Flores,José Alberto Viegas Caetano,María del Carmen Magariños.  (2004-10-28)  [Efficacy of biocides against hospital isolates of Staphylococcus sensitive and resistant to methicillin, in the province of Buenos Aires, Argentina]..  Revista panamericana de salud publica = Pan American journal of public health,  16  ((3)): (187-192).  [PMID:15507186]
6. Corine J Houtman,Annemiek M Van Oostveen,Abraham Brouwer,Marja H Lamoree,Juliette Legler.  (2004-12-16)  Identification of estrogenic compounds in fish bile using bioassay-directed fractionation..  Environmental science & technology,  38  ((23)): (6415-6423).  [PMID:15597899]
7. Chao Liu.  (2005-04-06)  [Simultaneous determination of chloroxylenol, trilocarban and triclosan in cosmetics or household products by reversed-phase high performance liquid chromatography]..  Se pu = Chinese journal of chromatography,  22  ((6)): (659-659).  [PMID:15807127]
8. R O Darouiche,M D Mansouri,E M Kojic.  (2006-03-10)  Antifungal activity of antimicrobial-impregnated devices..  Clinical microbiology and infection : the official publication of the European Society of Clinical Microbiology and Infectious Diseases,  12  ((4)): (397-399).  [PMID:16524420]
9. Cindy Berthelot,Matthew J Zirwas.  (2006-09-08)  Allergic contact dermatitis to chloroxylenol..  Dermatitis : contact, atopic, occupational, drug,  17  ((3)): (156-159).  [PMID:16956470]
10. Morgan Wilson,Christen Mowad.  (2007-05-15)  Chloroxylenol..  Dermatitis : contact, atopic, occupational, drug,  18  ((2)): (120-121).  [PMID:17498419]
11. Bram Baert,Eric Deconinck,Mireille Van Gele,Marian Slodicka,Paul Stoppie,Samuel Bodé,Guido Slegers,Yvan Vander Heyden,Jo Lambert,Johan Beetens,Bart De Spiegeleer.  (2007-09-11)  Transdermal penetration behaviour of drugs: CART-clustering, QSPR and selection of model compounds..  Bioorganic & medicinal chemistry,  15  ((22)): (6943-6955).  [PMID:17827020]
12. Vikrant Vijay,James L Yeatts,Jim E Riviere,Ronald E Baynes.  (2007-11-22)  Predicting dermal permeability of biocides in commercial cutting fluids using a LSER approach..  Toxicology letters,  175  ((1-3)): (34-43).  [PMID:18029120]
13. M D Mansouri,R O Darouiche.  (2007-11-29)  In-vitro activity and in-vivo efficacy of catheters impregnated with chloroxylenol and thymol against uropathogens..  Clinical microbiology and infection : the official publication of the European Society of Clinical Microbiology and Infectious Diseases,  14  ((2)): (190-192).  [PMID:18042195]
14. Mary Beth Digison.  (2008-01-01)  A review of anti-septic agents for pre-operative skin preparation..  Plastic surgical nursing : official journal of the American Society of Plastic and Reconstructive Surgical Nurses,  27  ((4)): (185-189).  [PMID:18165724]
15. Marcel Skoumal,Conchita Arias,Pere Lluís Cabot,Francesc Centellas,José Antonio Garrido,Rosa María Rodríguez,Enric Brillas.  (2008-02-12)  Mineralization of the biocide chloroxylenol by electrochemical advanced oxidation processes..  Chemosphere,  71  ((9)): (1718-1729).  [PMID:18262595]
16. Shuang Chang,Steven M Bray,Zigang Li,Daniela C Zarnescu,Chuan He,Peng Jin,Stephen T Warren.  (2008-03-11)  Identification of small molecules rescuing fragile X syndrome phenotypes in Drosophila..  Nature chemical biology,  4  ((4)): (256-263).  [PMID:18327252]
17. Lisa E Maier,Heather P Lampel,Tina Bhutani,Sharon E Jacob.  (2009-07-08)  Hand dermatitis: a focus on allergic contact dermatitis to biocides..  Dermatologic clinics,  27  ((3)): (251-264).  [PMID:19580920]
18. Christine Dellanno,Quinn Vega,Diane Boesenberg.  (2009-08-21)  The antiviral action of common household disinfectants and antiseptics against murine hepatitis virus, a potential surrogate for SARS coronavirus..  American journal of infection control,  37  ((8)): (649-652).  [PMID:19692148]
19. Denis Fourches,Julie C Barnes,Nicola C Day,Paul Bradley,Jane Z Reed,Alexander Tropsha.  (2009-12-18)  Cheminformatics analysis of assertions mined from literature that describe drug-induced liver injury in different species..  Chemical research in toxicology,  23  ((1)): (171-183).  [PMID:20014752]
20. Wenjue Zhong,Donghong Wang,Xiaowei Xu,Qian Luo,Bingyi Wang,Xiaoquan Shan,Zijian Wang.  (2010-06-19)  Screening level ecological risk assessment for phenols in surface water of the Taihu Lake..  Chemosphere,  80  ((9)): (998-1005).  [PMID:20557922]
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