产品说明
一般描述
Methyl 4-isocyanatobenzoate is an organic building block containing an isocyanate group.
应用
Methyl 4-isocyanatobenzoate may be used in the preparation of benzimidazole-1-carboxamide-[N-(4-methylbenzoate)] 2-methylcarbamate. This compound shows significant antitumor potency against the prostate cancer cells.
包装
5 g in glass bottle
基本信息
线性分子式 | OCNC6H4CO2CH3 |
分子量 | 177.16 |
MDL编号 | MFCD01863690 |
PubChem化学物质编号 | 24873592 |
NACRES | NA.22 |
产品性质
质量水平 | 100 |
测定 | 98% |
mp | 50-52 ℃ (lit.) |
储存温度 | 2-8℃ |
SMILES string | COC(=O)c1ccc(cc1)N=C=O |
InChI | 1S/C9H7NO3/c1-13-9(12)7-2-4-8(5-3-7)10-6-11/h2-5H,1H3 |
InChI key | FQDDBYGPHUUTRN-UHFFFAOYSA-N |
安全信息
象形图 | |
警示用语: | Danger |
危险声明 | H302 + H312 + H332 - H315 - H317 - H319 - H334 - H335 |
预防措施声明 | P261 - P264 - P280 - P301 + P312 - P302 + P352 + P312 - P305 + P351 + P338 |
危险分类 | Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3 |
靶器官 | Respiratory system |
储存分类代码 | 11 - Combustible Solids |
WGK | WGK 3 |
闪点(F) | 230.0 °F - closed cup |
闪点(C) | 110 ℃ - closed cup |
个人防护装备 | dust mask type N95 (US), Eyeshields, Faceshields, Gloves |
Sigma-Aldrich