基本描述

英文别名	NSC66496 \| NSC-66496 \| i-hexane \| Isohexane, mixture of isomeric branched chain hexanes, < 5% n-hexane \| Q209445 \| UNII-49IB0U6MLD \| DTXCID509143 \| 1,1-Dimethylbutane \| MFCD02179311 \| 2-METHYLPENTANE \| 2-Methyl-pentane \| (CH3)2CH(CH2)2CH3 \| 2-Methyl penta
规格或纯度	≥90%, mixture of isomers
英文名称	2-methylpentane
运输条件	常规运输
产品介绍	不溶于水，溶于乙醇、乙醚、苯等多数有机溶剂，蒸汽压53.32kPa/41.6℃用作溶剂、有机合成中间体、化学试剂。
纯度	≥90%

关联靶点（其它种属）

Oryctolagus cuniculus (11301 活性数据)

点击查看此靶标相关信息

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	504751495
EC号	203-523-4
分子类型	小分子
IIUPAC Name	2-methylpentane
INCHI	1S/C6H14/c1-4-5-6(2)3/h6H,4-5H2,1-3H3
InChi Key	AFABGHUZZDYHJO-UHFFFAOYSA-N
Smiles	CCCC(C)C
Isomeric SMILES	CCCC(C)C
UN Number	1208
Packing Group	II
分子量	86.17
Beilstein号	1730735
Reaxy-Rn	1730735
Reaxys-RN link address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1730735&ln=

化学和物理性质

密度	0.66
折光率	1.37-1.372
闪点(℉)	-9.4℉
闪点(℃)	-23 ℃
沸点	62°C
熔点	-154°C
分子量	86.180 g/mol
XLogP3	3.200
氢键供体数Hydrogen Bond Donor Count	0
氢键受体数Hydrogen Bond Acceptor Count	0
可旋转键计数Rotatable Bond Count	2
精确质量Exact Mass	86.1096 Da
单同位素质量Monoisotopic Mass	86.1096 Da
拓扑极表面积Topological Polar Surface Area	0.000 Å²
重原子数Heavy Atom Count	6
形式电荷Formal Charge	0
复杂度Complexity	21.200
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）

一般危化品	一般危化品
象形图	GHS02, GHS07, GHS08, GHS09
信号词	危险
危险声明	H225: 高度易燃的液体和蒸气 H304: 吞咽并进入呼吸道可能致命 H315: 引起皮肤刺激 H336: 可能引起嗜睡或头晕 H411: 对水生生物有毒并具有长期持续影响
预防措施声明	P210: 远离热源，热表面，火花，明火和其他点火源。 - 禁止抽烟。 P233: 保持容器密闭。 P240: 地面/粘结容器和接收设备 P241: 使用防爆的[电气/通风/照明/.../]设备。 P242: 仅使用无火花的工具。 P243: 采取防静电措施 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。 P271: 仅在室外或通风良好的地方使用。 P273: 避免释放到环境中。 P280: 戴防护手套/穿防护服/戴防护眼罩/戴防护面具。 P331: 不要催吐 P391: 收集溢出物 P301+P310: 如误吞咽：立即呼叫急救中心/医生。 P303+P361+P353: 如皮肤（或头发）沾染：立即脱掉所有沾染的衣服。用水清洗皮肤/淋浴。 P332+P313: 如发生皮肤刺激：求医/就诊。 P370+P378: 火灾时：使用干砂、干粉或抗醇泡沫灭火。 P405: 密闭存放 P403+P233: 存放在通风良好的地方。保持容器密闭。 P403+P235: 存放在通风良好的地方。保持低温。 P501: 将内容物/容器处理到。。。 P304+P340+P312: 如误吸入：将人转移到空气新鲜处，保持呼吸舒适体位。如感觉不适，呼叫急救中心/医生。
WGK Germany	2
RTECS	SA2985000
Class	3
个人防护装备	Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US)

质检证书（CoA,COO,BSE/TSE 和分析图谱)

C of A & Other Certificates(BSE/TSE, COO):

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找到6个结果

批号(Lot Number)	证书类型	货号
G2130344	分析证书	M137744
A2129170	分析证书	M137744
A2129169	分析证书	M137744
A2129171	分析证书	M137744
F2326171	分析证书	M137744
D23191027	分析证书	M137744

此产品的引用文献

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引用文献

1. J B Galvin,G Bond. (1999-10-28) 2-Methylpentane (isohexane). CAS# 107-83-5.. Journal of toxicology and environmental health. Part A, 58 ((1-2)): (81-92). [PMID:10537374]
2. M Ojala,M Poutanen,I Mattila,R A Ketola,T Kotiaho,R Kostiainen. (2000-06-09) Analysis of residual solvents in pharmaceuticals with purge-and-membrane mass spectrometry.. Rapid communications in mass spectrometry : RCM, 14 ((11)): (994-998). [PMID:10844737]
3. Y C Hsu,J H Tsai,H W Chen,W Y Lin. (2000-12-02) Tunnel study of on-road vehicle emissions and the photochemical potential in Taiwan.. Chemosphere, 42 ((3)): (227-234). [PMID:11100921]
4. Michael H Abraham,Adam Ibrahim,William E Acree. (2007-06-05) Air to lung partition coefficients for volatile organic compounds and blood to lung partition coefficients for volatile organic compounds and drugs.. European journal of medicinal chemistry, 43 ((3)): (478-485). [PMID:17544548]
5. A A Toropov,A P Toropova,I Raska. (2007-07-17) QSPR modeling of octanol/water partition coefficient for vitamins by optimal descriptors calculated with SMILES.. European journal of medicinal chemistry, 43 ((4)): (714-740). [PMID:17629592]
6. Haijing Wang,Helmut Geppert,Thomas Fischer,Wolfgang Wieprecht,Detlev Möller. (2014-09-17) Determination of volatile organic and polycyclic aromatic hydrocarbons in crude oil with efficient gas-chromatographic methods.. Journal of chromatographic science, 53 ((5)): (647-654). [PMID:25225200]
7. Zulin Zhang,Thibault Lefebvre,Christine Kerr,Mark Osprey. (2014-10-02) Simultaneous extraction and determination of various pesticides in environmental waters.. Journal of separation science, 37 ((24)): (3699-3705). [PMID:25271968]
8. Chang Li,Shao-Ping Nie,Yong-Qiang Zhou,Ming-Yong Xie. (2014-12-03) Exposure assessment of 3-monochloropropane-1, 2-diol esters from edible oils and fats in China.. Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association, 75 (8-13). [PMID:25447762]
9. Cecilia Karlsson,Stephan Hjorth,Martin Karpefors,Göran I Hansson,Björn Carlsson. (2014-12-31) Baseline anandamide levels and body weight impact the weight loss effect of CB1 receptor antagonism in male rats.. Endocrinology, 156 ((4)): (1237-1241). [PMID:25549047]
10. Andrea N Giordano,Benjamin J Lear. (2015-03-27) Comparing the energetic and dynamic contributions of solvent to very low barrier isomerization using dynamic steady-state vibrational spectroscopy.. The journal of physical chemistry. A, 119 ((15)): (3545-3555). [PMID:25811244]
11. Chang Li,Hanbing Jia,Mingyue Shen,Yuting Wang,Shaoping Nie,Yi Chen,Yongqiang Zhou,Yuanxing Wang,Mingyong Xie. (2015-10-20) Antioxidants Inhibit Formation of 3-Monochloropropane-1,2-diol Esters in Model Reactions.. Journal of agricultural and food chemistry, 63 ((44)): (9850-9854). [PMID:26478126]
12. M Imbriani. (1993-09-01) The pulmonary capillary blood flow (Qc) at rest and work measured simultaneously by 3 inert substances.. Giornale italiano di medicina del lavoro, 15 ((5-6)): (133-138). [PMID:7615173]
13. Yin Xie, Xiaowei Xu, Yan Cui, Liang Qiao, Kebin Chi, Dejun Shi, Yang Bai, Zhijie Wu, Shengbao He. (2023) Colloidal chemistry of MAPbI3 perovskite ink using 2-methoxyethanol as the solvent. COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS, 677 (132406). [10.1016/j.colsurfa.2023.132406]
14. Ziqi Sun, Meiling Qi. (2022) High separation performance of carbon dioxide-based poly(ether-carbonate) copolymer for gas chromatographic analyses. JOURNAL OF CHROMATOGRAPHY A, 1682 (463493). [PMID:36166885] [10.1016/j.chroma.2022.463493]
15. Ruijuan Duan, Meiling Qi. (2021) Amphiphilic triblock copolymer as the gas chromatographic stationary phase with high-resolution performance towards a wide range of isomers and the components of lemon essential oil. JOURNAL OF CHROMATOGRAPHY A, 1658 (462611). [PMID:34666270] [10.1016/j.chroma.2021.462611]
16. Lele Jin, Wenzhi Li, Qiying Liu, Longlong Ma, Chao Hu, Ajibola T. Ogunbiyi, Mingwei Wu, Qi Zhang. (2020) High performance of Mo-promoted Ir/SiO2 catalysts combined with HZSM-5 toward the conversion of cellulose to C5/C6 alkanes. BIORESOURCE TECHNOLOGY, 297 (122492). [PMID:31796376] [10.1016/j.biortech.2019.122492]
17. Lele Jin, Wenzhi Li, Qiying Liu, Longlong Ma, Song Li, Yang Liu, Baikai Zhang, Qi Zhang. (2019) Catalytic conversion of cellulose to C5/C6 alkanes over Ir-VOx/SO2 combined with HZSM-5 in n-dodecane/water system. FUEL PROCESSING TECHNOLOGY, 196 (106161). [10.1016/j.fuproc.2019.106161]
18. Yuan-Yuan Cui, Huan Yao, Cheng-Xiong Yang, Xiu-Ping Yan. (2019) In situ fabrication of microporous organic network coated capillary column for high resolution gas chromatographic separation of hydrocarbons. ELECTROPHORESIS, 40 (16-17): (2186-2192). [PMID:30942493] [10.1002/elps.201800540]
19. Lin Fan, Xiu-Ping Yan. (2012) Evaluation of isostructural metal–organic frameworks coated capillary columns for the gas chromatographic separation of alkane isomers. TALANTA, 99 (944). [PMID:22967647] [10.1016/j.talanta.2012.07.063]
20. Xue Xiong,Meiling Qi. (2018-08-14) Hexagonal boron nitride stationary phase for gas chromatography.. Journal of chromatography. A, 1567 (191-197). [PMID:30100014]
21. Qian Yuan,Meiling Qi. (2020-04-19) Triptycene-based dicationic guanidinium ionic liquid: A novel stationary phase of high selectivity towards a wide range of positional and structural isomers.. Journal of chromatography. A, 1621 (461084-461084). [PMID:32303345]
22. Xue Cao, Ruixin Qin, Shiyi Zhang, Weikeng Luo, Jiaxiang Qin, Xiao Yan, Fengshan Cai, Qilong Liao, Yunjiang Yu, Jing Zheng. (2024) Bisphenol pollutants bind with human hair keratin: Combining evidence from fluorescence spectroscopy and molecular docking. SCIENCE OF THE TOTAL ENVIRONMENT, 957 (177533). [PMID:39542267] [10.1016/j.scitotenv.2024.177533]
23. Yixin Kuang, Suxin Zhou, Cheng Mao, Xiaoying Feng, Juan Zheng, Gangfeng Ouyang. (2025) Cascading in-situ grown UiO-66 and alternative calix[n]arenes for high-resolution isomer separation. SEPARATION AND PURIFICATION TECHNOLOGY, 354 (129313). [10.1016/j.seppur.2024.129313]
24. Xuyao Tang, Yang Wang, Junwei Cui, Ke Zhang, Shengshan Bi. (2024) Dynamic viscosity, interfacial tension and diffusion coefficient of n-hexane, cyclohexane, 2-methylpentane with dissolved CO2. JOURNAL OF CHEMICAL THERMODYNAMICS, 199 (107360). [10.1016/j.jct.2024.107360]
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溶液计算器

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分子量

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稀释计算器

计算配制储备溶液所需的稀释度。

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复溶计算器

复溶计算器允许您快速计算试剂的体积，以复溶小瓶。只需输入试剂的质量和目标浓度，计算器将确定其余部分。

体积（添加到小瓶中）

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所需的复溶浓度

货号 (SKU)	包装规格	是否现货
M137744-25ml	25ml	现货
M137744-100ml	100ml	现货
M137744-500ml	500ml	现货

2-甲基戊烷

库存信息

库存信息

库存信息

基本描述

关联靶点（其它种属）

作用机制

名称和识别符

化学和物理性质

安全和危险性（GHS）

质检证书（CoA,COO,BSE/TSE 和分析图谱)

此产品的引用文献

引用文献

溶液计算器

摩尔浓度计算器

稀释计算器

复溶计算器