(2-Methyl-4-phenylquinolin-3-yl)acetic acid--hydrogen chloride (1/1)

HCID 20847932CAS 17401-15-9

基本情報

標準SMILES: Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)O.Cl
InChIKey: FSRDDXOKSKFDFO-UHFFFAOYSA-N
分子式: C18H16ClNO2
平均分子量: 313.8 g/mol
単同位体質量: 313.08695643

名称と識別子

優先名称: (2-Methyl-4-phenylquinolin-3-yl)acetic acid--hydrogen chloride (1/1)
IUPAC: 2-(2-methyl-4-phenylquinolin-3-yl)acetic acid;hydrochloride
英語名: (2-Methyl-4-phenylquinolin-3-yl)acetic acid hydrochloride ,97%
分子式: C18H16ClNO2
分子量: 313.78

名称と別名

17401-15-9DTXSID50610032(2-Methyl-4-phenylquinolin-3-yl)acetic acid--hydrogen chloride (1/1)RefChem:206164DTXCID305607882-(2-Methyl-4-phenylquinolin-3-yl)acetic acid hydrochloride943825-22-7(2-methyl-4-phenylquinolin-3-yl)acetic acid hydrochloride2-(2-methyl-4-phenylquinolin-3-yl)acetic acid;hydrochlorideSCHEMBL31658237TMB82522SB72388

名称をさらに表示

2-(2-Methyl-4-phenylquinolin-3-yl)acetic acid(2-Methyl-4-phenylquinolin-3-yl)acetic acid hydrochloride ,97%

DB-064931DB-079869EN300-08538F813852-(2-Methyl-4-phenylquinolin-3-yl)aceticacidhydrochloride(2-Methyl-4-phenylquinolin-3-yl)acetic acid hydrochloride, 97%

データベース識別子

CAS: 17401-15-9、943825-22-7
PubChem CID: 20847932
DTXSID: DTXSID50610032
EC Number: 980-250-3

物性

構造計算による物性

極性表面積: 50.2 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: 3
重原子数: 22
形式電荷: 0
複雑度: 364

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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.

危険有害性情報

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

化学と産業

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