(3-Chloro-5-methanesulfonylphenyl)methanamine hydrochloride

HCID 66877784CAS 1192347-69-5

基本情報

標準SMILES: CS(=O)(=O)c1cc(Cl)cc(CN)c1.Cl
InChIKey: LSNAFCARTGAZER-UHFFFAOYSA-N
分子式: C8H11Cl2NO2S
平均分子量: 256.15 g/mol
単同位体質量: 254.9887552

名称と識別子

優先名称: (3-Chloro-5-methanesulfonylphenyl)methanamine hydrochloride
IUPAC: (3-chloro-5-methylsulfonylphenyl)methanamine;hydrochloride

名称と別名

1192347-69-5(3-chloro-5-methanesulfonylphenyl)methanamine hydrochlorideRefChem:400087100-798-11-[3-chloro-5-(methylsulfonyl)phenyl]methanamine hydrochloride(3-chloro-5-methylsulfonylphenyl)methanamine;hydrochloride(3-Chloro-5-(methylsulfonyl)phenyl)methanamine hydrochlorideSCHEMBL1016985LSNAFCARTGAZER-UHFFFAOYSA-NSXB34769AT16968EN300-208991

名称をさらに表示

1-[3-CHLORO-5-(METHYLSULFONYL)PHENYL]METHANAMINE MONOHYDROCHLORIDE

データベース識別子

CAS: 1192347-69-5
PubChem CID: 66877784
EC Number: 100-798-1

物性

構造計算による物性

極性表面積: 68.5 Å²
水素結合供与体数: 2
水素結合受容体数: 3
回転可能結合数: 2
重原子数: 14
形式電荷: 0
複雑度: 260

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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.