CAS 435273-53-3 2-Bromo-1-(4-methylpyridin-3-yl)ethan-1-one hydrobromide (HCID 22730990)

基本情報

CAS: 435273-53-3
標準SMILES: Br.Cc1ccncc1C(=O)CBr
InChIKey: OVQVUSADZFZNNS-UHFFFAOYSA-N
分子式: C8H9Br2NO
平均分子量: 294.97 g/mol
単同位体質量: 292.90509

名称と識別子

優先名称: 2-Bromo-1-(4-methylpyridin-3-yl)ethan-1-one hydrobromide
IUPAC: 2-bromo-1-(4-methyl-3-pyridinyl)ethanone;hydrobromide

名称と別名

435273-53-32-bromo-1-(4-methylpyridin-3-yl)ethan-1-one hydrobromideRefChem:465969854-745-92-Bromo-1-(4-methyl-pyridin-3-yl)-ethanone Hydrobromide2-bromo-1-(4-methylpyridin-3-yl)ethan-1-onehydrobromide2-bromo-1-(4-methylpyridin-3-yl)ethanone;hydrobromideSCHEMBL5567775OVQVUSADZFZNNS-UHFFFAOYSA-NKSA27353DA-26959EN300-21001739

名称をさらに表示

2-bromo-1-(4-methylpyrid-3-yl)ethanone hydrobromide2-bromo-1-(4-methylpyridin-3-yl)ethanone hydrobromide

データベース識別子

CAS: 435273-53-3
PubChem CID: 22730990
EC Number: 854-745-9

物性

構造計算による物性

極性表面積: 30 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: 12
形式電荷: 0
複雑度: 149

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger 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+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.