(R)-beta-aminophenethyl alcohol

HCID 2724025CAS 56613-80-0

部分構造検索類似構造を探す

基本情報

標準SMILES: N[C@@H](CO)c1ccccc1
InChIKey: IJXJGQCXFSSHNL-QMMMGPOBSA-N
分子式: C8H11NO
平均分子量: 137.18 g/mol
単同位体質量: 137.08406397

概要

(R)-(-)-2-Phenylglycinol is an aralkylamine.

名称と識別子

優先名称: (R)-beta-aminophenethyl alcohol
IUPAC: (2R)-2-amino-2-phenylethanol

名称と別名

56613-80-0(-)-phenylglycinol(R)-beta-Aminophenethyl alcoholDTXSID10205180EINECS 260-287-5RefChem:407383DTXCID10127671260-287-5D-Phenylglycinol(R)-(-)-2-Phenylglycinol(R)-2-Phenylglycinol(R)-2-Amino-2-phenylethanol

名称をさらに表示

(2R)-2-amino-2-phenylethanol(2R)-2-Amino-2-Phenylethan-1-Ol(r)-phenylglycinol(R)-(-)-2-Amino-2-phenylethanolMFCD00008062(2R)-2-amino-2-phenyl-ethanolD-Plenylglycinol(R)-2-amino-2-phenylethan-1-ol

データベース識別子

CAS: 56613-80-0
PubChem CID: 2724025
DTXSID: DTXSID10205180
ChEMBL: CHEMBL1907936
ChEBI: CHEBI:180555
UNII: ZKT57P3QLR
EC Number: 260-287-5
Nikkaji: J35.844D

物性

構造計算による物性

XLogP: 0.1
極性表面積: 46.3 Å²
水素結合供与体数: 2
水素結合受容体数: 2
回転可能結合数: 2
重原子数: 10
形式電荷: 0
複雑度: 89.3

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)

Aggregated GHS information provided per 14 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.