(1R)-2,2,2-trifluoro-1-(4-fluorophenyl)ethan-1-ol

HCID 12640348CAS 848926-12-5

基本情報

標準SMILES: O[C@H](c1ccc(F)cc1)C(F)(F)F
InChIKey: BDQHSIMDNYIOMB-SSDOTTSWSA-N
分子式: C8H6F4O
平均分子量: 194.13 g/mol

名称と識別子

優先名称: (1R)-2,2,2-trifluoro-1-(4-fluorophenyl)ethan-1-ol
IUPAC: (1R)-2,2,2-trifluoro-1-(4-fluorophenyl)ethanol

名称と別名

848926-12-5(1R)-2,2,2-trifluoro-1-(4-fluorophenyl)ethan-1-olRefChem:393035959-247-6(R)-2,2,2-Trifluoro-1-(4-fluorophenyl)ethan-1-ol(R)-alpha-(Trifluoromethyl)-4-fluorobenzenemethanolSCHEMBL1273068MFCD22741885SY477664H810512,2,2-trifluoro-1(R)-(4-fluorophenyl)ethanolEN300-1929548

名称をさらに表示

(1R)-2,2,2-trifluoro-1-(4-fluorophenyl)ethanol(R)-2,2,2-Trifluoro-1-(4-fluorophenyl)ethanol2,2,2-trifluoro-1 (R)-(4-fluorophenyl)ethanol

データベース識別子

CAS: 848926-12-5
PubChem CID: 12640348
EC Number: 959-247-6
Nikkaji: J371.093I

物性

構造計算による物性

XLogP: 2.3
極性表面積: 20.2 Å²
水素結合供与体数: 1
水素結合受容体数: 5
回転可能結合数: 1
重原子数: 13
形式電荷: 0
複雑度: 160

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

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.