CAS 593270-22-5 2-Bromo-1-(2-ethylphenyl)ethan-1-one (HCID 23442601)

基本情報

CAS: 593270-22-5
標準SMILES: CCc1ccccc1C(=O)CBr
InChIKey: QAYCTBUGKWGQKZ-UHFFFAOYSA-N
分子式: C10H11BrO
平均分子量: 227.1 g/mol

名称と識別子

優先名称: 2-Bromo-1-(2-ethylphenyl)ethan-1-one
IUPAC: 2-bromo-1-(2-ethylphenyl)ethanone
英語名: Ethanone, 2-bromo-1-(2-ethylphenyl)- (9CI)
分子式: C10H11BrO
分子量: 227.1

名称と別名

593270-22-52-bromo-1-(2-ethylphenyl)ethan-1-oneRefChem:465880854-749-02-Bromo-1-(2-ethylphenyl)ethanoneEthanone, 2-bromo-1-(2-ethylphenyl)-Ethanone, 2-bromo-1-(2-ethylphenyl)- (9CI)o-ethylphenacyl bromide2-ethyl phenacylbromideSCHEMBL3928994QAYCTBUGKWGQKZ-UHFFFAOYSA-NTYA27022

名称をさらに表示

2-bromo-1-(2-ethylphenyl)-ethanone2-bromo-1-(2-ethyl-phenyl)-ethanoneAKOS0175483102-Bromo-1-(2-ethyl-phenyl) -ethanoneDB-326311EN300-5107695

データベース識別子

CAS: 593270-22-5
PubChem CID: 23442601
EC Number: 854-749-0

物性

構造計算による物性

XLogP: 3.2
極性表面積: 17.1 Å²
水素結合供与体数: 0
水素結合受容体数: 1
回転可能結合数: 3
重原子数: 12
形式電荷: 0
複雑度: 156

物理化学的性質

沸点: 281.8 · 281.8±23.0 °C(Predicted)
比重(密度): 1.36 · 1.360±0.06 g/cm3(Predicted)

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H227 (100%): Combustible liquid [Warning Flammable liquids]

P210, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P370+P378, P403, 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.