CAS 32631-26-8 3-Chloro-4-(phenylsulfanyl)aniline (HCID 23438083)

基本情報

CAS: 32631-26-8
標準SMILES: Nc1ccc(Sc2ccccc2)c(Cl)c1
InChIKey: CKRNYBQUMRCICU-UHFFFAOYSA-N
分子式: C12H10ClNS
平均分子量: 235.73 g/mol

名称と識別子

優先名称: 3-Chloro-4-(phenylsulfanyl)aniline
IUPAC: 3-chloro-4-phenylsulfanylaniline
英語名: 3-chloro-4-(phenylsulfanyl)aniline
分子式: C12H10ClNS
分子量: 235.73

名称と別名

3-chloro-4-(phenylsulfanyl)aniline32631-26-83-chloro-4-phenylsulfanylaniline3-chloro-4-thiophenoxyanilineSCHEMBL52532103-chloro-4-(phenylthio)aniline3-chloro-4-phenylsulfanyl-anilineCKRNYBQUMRCICU-UHFFFAOYSA-NHBA63126AKOS0002155244-amino-2-chlorophenyl phenyl sulphideNCGC00322958-01

名称をさらに表示

Benzenamine, 3-chloro-4-(phenylthio)-

CS-0253108EN300-62434G34367AB01185467-03Z330802834

データベース識別子

CAS: 32631-26-8
PubChem CID: 23438083
EC Number: 164-203-7

物性

構造計算による物性

XLogP: 3.9
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: 2
重原子数: 15
形式電荷: 0
複雑度: 194

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.