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Butachlor solution - 10μg/ml,l, matrix: petroleum ether, high purity , CAS No.23184-66-9
Basic Description
Synonyms
Butachlor, analytical standard | HY-B2042 | NCGC00254842-01 | N-n-butoxymethyl-N-(2,6-diethylphenyl)chloroacetamide | Amichlor | 94NU90OO5K | Butachlor [ANSI:BSI:ISO] | NSC221683 | NSC-221683 | BUTACHLOR | CAS-23184-66-9 | HKPHPIREJKHECO-UHFFFAOYSA- | NCG
Specifications & Purity
analytical standard, 10ug/ml in acetone
Shipped In
Normal
Grade
analytical standard
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Anilides
Intermediate Tree Nodes
Not available
Direct Parent
Anilides
Alternative Parents
Tertiary carboxylic acid amides Chloroacetamides Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Anilide - Tertiary carboxylic acid amide - Chloroacetamide - Carboxamide group - Carboxylic acid derivative - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alkyl halide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as anilides. These are organic heterocyclic compounds derived from oxoacids RkE(=O)l(OH)m (l not 0) by replacing an OH group by the NHPh group or derivative formed by ring substitution.
External Descriptors
Anilide herbicides
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Associated Targets(Human)
Associated Targets(non-human)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
IUPAC Name
N-(butoxymethyl)-2-chloro-N-(2,6-diethylphenyl)acetamide
INCHI
InChI=1S/C17H26ClNO2/c1-4-7-11-21-13-19(16(20)12-18)17-14(5-2)9-8-10-15(17)6-3/h8-10H,4-7,11-13H2,1-3H3
InChIKey
HKPHPIREJKHECO-UHFFFAOYSA-N
Smiles
CCCCOCN(C1=C(C=CC=C1CC)CC)C(=O)CCl
Isomeric SMILES
CCCCOCN(C1=C(C=CC=C1CC)CC)C(=O)CCl
WGK Germany
3
RTECS
AE1200000
Molecular Weight
311.85
Beilstein
2873811
Reaxy-Rn
2873811
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2873811&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Flash Point(°C)
100°C
Molecular Weight
311.800 g/mol
XLogP3
4.500
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
9
Exact Mass
311.165 Da
Monoisotopic Mass
311.165 Da
Topological Polar Surface Area
29.500 Ų
Heavy Atom Count
21
Formal Charge
0
Complexity
287.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
Citations of This Product
1.
Linwei Zhang, Xiaoyang Yin, Hongfei Yang, Hao Wen, Shiyun Han, Xiaoming Pan, Huaming Li, Dapeng Peng.
(2024)
A Sensitive and Specific Monoclonal Antibody Based Enzyme-Linked Immunosorbent Assay for the Rapid Detection of Pretilachlor in Grains and the Environment. Foods,
13
(1):
(12).
2.
Liling Wang, Yanbin Wang, Yuchuan Qin, Yifeng Zhou.
(2023)
Room-temperature synthesis of ionic liquid@covalent organic frameworks for the solid phase extraction and analysis of six herbicides from water samples. MICROCHEMICAL JOURNAL,
195
(109497).
3.
Yi Wu, Liyuan Zhang, Dongjie Zhang, Runzhong Yu.
(2024)
A surface molecularly imprinted microfluidic paper based device with smartphone assisted colorimetric detection for butachlor in mung bean. FOOD CHEMISTRY,
435
(137659).
4.
Zepeng Li, Yuxiang Wu, Zijing Li, Binger Yu, Xinyi Mao, Guoqing Shi.
(2023)
A lateral flow immunoassay method for the rapid detection of acetochlor and alachlor in vegetable oil by sensitivity enhancement by using dimethyl-β-cyclodextrin. Analytical Methods,
15
(38):
(5087-5094).
5.
Shuheng Hu, Xin Jin, Xueyan Chen, Bin Lv, Wenhao Xi, Yan Lan, Wei Han, Zimu Xu, Cheng Cheng.
(2023)
Butachlor (BTR) degradation by dielectric barrier discharge plasma in soil: Affecting factors, degradation route, and toxicity assessment. CHEMOSPHERE,
337
(139414).
6.
Xiong Chen, Yingxue Li, Juying Li, Li Cao, Cheng Yao.
(2023)
An upconverted nanoparticle–porphyrin metal–organic framework platform for near-infrared detection of nitenpyram. Analytical Methods,
15
(24):
(2946-2954).
7.
Jing Yu, Hui Zhu, Heli Wang, Brian Shutes, Tingting Niu.
(2023)
Effect of butachlor on Microcystis aeruginosa: Cellular and molecular mechanisms of toxicity. JOURNAL OF HAZARDOUS MATERIALS,
449
(131042).
8.
Xinyue Zheng, Xujian Duan, Di Lu, Qiuhong Jiang, Yajun Liu, Hongyu Xue, Jiansong You, Lei Yin, Meiyun Shi.
(2022)
Cellular toxicity and pharmacokinetic study of butachlor by ultra-performance liquid chromatography-tandem mass spectrometry based on tandem mass spectrometry cubed technique. JOURNAL OF SEPARATION SCIENCE,
46
(1):
(2200725).
9.
Yifei Sun, Yan Tang, Zetao Chen, Miaoxiu Ge, Wei Xiong, Luhong Wen.
(2024)
A Facile Determination of Herbicide Residues and Its Application in On-Site Analysis. Foods,
13
(8):
(1280).
10.
Di Lu, Xinyue Zheng, Hongyu Xue, Jiansong You, Lei Yin, Meiyun Shi.
(2024)
Determination of acetochlor by UPLC-MS3 in cells and its application to a cellular pharmacokinetic study. ANALYTICAL BIOCHEMISTRY,
688
(115476).
11.
Ma Rong, Yu Shuangshuang, Li Yafang, Lin Yan, Ma Xiaodong.
(2024)
Enhancing the efficiency of polypyrrole-dodecylbenzene sulfonic acid in-tube solid-phase microextraction coating for analysis of nitrogen-containing pesticides in water environments. Frontiers in Environmental Science,
12
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11 Citations
G2213463