CAS 60710-81-8 2-Methyl-3-(methylthio)benzenamine (HCID 18408360)

基本情報

CAS: 60710-81-8
標準SMILES: CSc1cccc(N)c1C
InChIKey: OXTWAZXCUFWICU-UHFFFAOYSA-N
分子式: C8H11NS
平均分子量: 153.25 g/mol
単同位体質量: 153.06122035

名称と識別子

優先名称: 2-Methyl-3-(methylthio)benzenamine
IUPAC: 2-methyl-3-methylsulfanylaniline

名称と別名

2-methyl-3-(methylsulfanyl)aniline60710-81-8DTXSID7012955982-Methyl-3-(methylthio)benzenamineRefChem:475330DTXCID001726124865-828-42-Methyl-3-methylthioaniline2-Methyl-3-(methylthio)aniline2-methyl-3-methylsulfanylanilineSCHEMBL74630212-methyl-3-methylsulfanyl-aniline

名称をさらに表示

OXTWAZXCUFWICU-UHFFFAOYSA-NKCA71081AKOS012363601AT20858CS-0232082EN300-126249F650540Z1080528870

データベース識別子

CAS: 60710-81-8
PubChem CID: 18408360
DTXSID: DTXSID701295598
EC Number: 865-828-4

物性

構造計算による物性

XLogP: 2.1
極性表面積: 51.3 Å²
水素結合供与体数: 1
水素結合受容体数: 2
回転可能結合数: 1
重原子数: 10
形式電荷: 0
複雑度: 105

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

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

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+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.