2-フェニルベンジルアミン HYDROCHLORIDE

1-Biphenyl-2-ylmethanamine

HCID 263366

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 1924-77-2
標準SMILES: NCc1ccccc1-c1ccccc1
InChIKey: YHXKXVFQHWJYOD-UHFFFAOYSA-N
分子式: C13H13N
平均分子量: 183.25 g/mol
単同位体質量: 183.10479942

名称と識別子

優先名称: 1-Biphenyl-2-ylmethanamine
IUPAC: (2-phenylphenyl)methanamine
現地名: 2-フェニルベンジルアミン HYDROCHLORIDE
英語名: 2-Phenylbenzylamine hydrochloride
分子式: C13H13N
分子量: 183.25

名称と別名

(2-phenylphenyl)methanamine1-Biphenyl-2-YlmethanamineRefChem:750241924-77-22-Phenylbenzylamine[1,1'-biphenyl]-2-ylmethanamine[1,1'-Biphenyl]-2-methanaminebiphenyl-2-methanamineMFCD002701232-phenyl-phenylmethyl amineCHEMBL257036DTXSID50940902

名称をさらに表示

2-フェニルベンジルアミン HYDROCHLORIDE2-フェニルベンジルアミン2-(アミノメチル)ビフェニル2-AMinoMethylbiphenyl2-Phenylbenzylamine ,98%1,1'-Biphenyl]-2-methanamine2-Phenylbenzylamine hydrochloride

1-{[1,1'-biphenyl]-2-yl}methanaminePD005208C78012(2-phenylphenyl)methylamineBiphenyl-2-methanamine HCl1-([1,1'-Biphenyl]-2-yl)methanamineo-Phenylbenzyo-Phenylbenzylamin

データベース識別子

CAS: 1924-77-2
PubChem CID: 263366
DTXSID: DTXSID50940902
ChEMBL: CHEMBL257036
EC Number: 671-207-7

物性

構造計算による物性

XLogP: 2.4
極性表面積: 26 Å²
水素結合供与体数: 1
水素結合受容体数: 1
回転可能結合数: 2
重原子数: 14
形式電荷: 0
複雑度: 161

物理化学的性質

沸点: 106 °C · 106°C 1mm
比重(密度): 1 · 1,06 g/cm3
貯蔵温度: Keep in dark place,Inert atmosphere,Room temperature
酸解離定数(Pka): 8.97 · 8.97±0.10(Predicted)
比重: 1.06 · 1.06
CAS データベース: 1924 · 1924-77-2(CAS DataBase Reference)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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.