产品说明
一般描述
3-Methylhippuric acid is also referred as m-methyl-hippuric acid. It is major product of xylene biotransformation in urine.
应用
3-Methylhippuric acid was employed as biological marker in studies on occupational exposure to xylene (solvent).
包装
1 g in glass bottle
其他说明
Tandem Mass Spectrometry data independently generated by Scripps Center for Metabolomics is available to view or download in PDF. 328014.pdf Tested metabolites are featured on Scripps Center for Metabolomics METLIN Metabolite Database. To learn more, visit sigma.com/metlin.
基本信息
线性分子式 | CH3C6H4CONHCH2CO2H |
分子量 | 193.20 |
MDL编号 | MFCD00044399 |
PubChem化学物质编号 | 24859707 |
NACRES | NA.22 |
产品性质
质量水平 | 100 |
测定 | 98% |
mp | 138-140 ℃ (lit.) |
SMILES string | Cc1cccc(c1)C(=O)NCC(O)=O |
InChI | 1S/C10H11NO3/c1-7-3-2-4-8(5-7)10(14)11-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)(H,12,13) |
InChI key | YKAKNMHEIJUKEX-UHFFFAOYSA-N |
安全信息
储存分类代码 | 13 - Non Combustible Solids |
WGK | WGK 3 |
闪点(F) | Not applicable |
闪点(C) | Not applicable |
个人防护装备 | Eyeshields, Gloves, type N95 (US) |
Sigma-Aldrich