CAS 92311-35-8 4-Chloro-6-(chloromethyl)pyrimidin-2-amine (HCID 20153488)

基本情報

CAS: 92311-35-8
標準SMILES: Nc1nc(Cl)cc(CCl)n1
InChIKey: MIRFGLZGZZWAQK-UHFFFAOYSA-N
分子式: C5H5Cl2N3
平均分子量: 178.02 g/mol

名称と識別子

優先名称: 4-Chloro-6-(chloromethyl)pyrimidin-2-amine
IUPAC: 4-chloro-6-(chloromethyl)pyrimidin-2-amine

名称と別名

4-chloro-6-(chloromethyl)pyrimidin-2-amine92311-35-8RefChem:521550849-201-2SCHEMBL10617507MIRFGLZGZZWAQK-UHFFFAOYSA-NSDA311352-amino-4-chloro-6-chloromethylpyrimidine2-amino-4-chloro-6-chloromethyl-pyrimidineDB-094817CS-0458036EN300-7542458

データベース識別子

CAS: 92311-35-8
PubChem CID: 20153488
EC Number: 849-201-2

物性

構造計算による物性

XLogP: 1.2
極性表面積: 51.8 Å²
水素結合供与体数: 1
水素結合受容体数: 3
回転可能結合数: 1
重原子数: 10
形式電荷: 0
複雑度: 111

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.