3-溴-4-甲氧基乙酰苯胺

N-(3-bromo-4-methoxyphenyl)acetamide

HCID 244158CAS 6943-73-3

子结构检索查找相似结构

基本信息

标准SMILES: COc1ccc(NC(C)=O)cc1Br
InChIKey: FOMGGBXHSUSZFZ-UHFFFAOYSA-N
分子式: C9H10BrNO2
平均分子量: 244.08 g/mol
单同位素质量: 242.98949

名称与标识

首选名称: N-(3-bromo-4-methoxyphenyl)acetamide
IUPAC: N-(3-bromo-4-methoxyphenyl)acetamide
中文名: 3-溴-4-甲氧基乙酰苯胺
英文名: N-(3-bromo-4-methoxyphenyl)Acetamide
分子式: C9H10BrNO2
分子量: 244.09

名称与别名

n-(3-bromo-4-methoxyphenyl)acetamideRefChem:826221845-623-66943-73-3MFCD04094340NSC547822-Bromo-4-acetaminoanisoleOprea1_848360SCHEMBL3997305SCHEMBL30355120DTXSID00989280FOMGGBXHSUSZFZ-UHFFFAOYSA-N

展开更多名称

N-(3-溴-4-甲氧苯基)醋胺石N-(3-溴-4-甲氧基苯基)乙酰胺3-BROMO-4-METHOXYACETANILIDEAcetamide, N-(3-bromo-4-methoxyphenyl)-

GAA94373NSC-54782AKOS003198310AS-44085DA-03515CS-0454992N-(3-Bromo-4-methoxyphenyl)ethanimidic acidEN300-136655

数据库标识

CAS: 6943-73-3
PubChem CID: 244158
DTXSID: DTXSID00989280
EC Number: 845-623-6
Nikkaji: J568.856F

性质

结构计算性质

XLogP: 1.9
极性表面积: 38.3 Å²
氢键供体: 1
氢键受体: 2
可旋转键: 2
重原子: 13
形式电荷: 0
复杂度: 186

安全与法规

GHS分类

GHS Classification · 5 条

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；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, 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.