1-(2-萘基)甲胺

1-(2-Naphthyl)methanamine

HCID 137282CAS 2018-90-8

子结构检索查找相似结构

基本信息

标准SMILES: NCc1ccc2ccccc2c1
InChIKey: XBCAHQUVHHVHHL-UHFFFAOYSA-N
分子式: C11H11N
平均分子量: 157.21 g/mol
单同位素质量: 157.08914935

名称与标识

首选名称: 1-(2-Naphthyl)methanamine
IUPAC: naphthalen-2-ylmethanamine
中文名: 1-(2-萘基)甲胺
英文名: 1-(2-NAPHTHYL)METHANAMINE
分子式: C11H11N
分子量: 157.21

名称与别名

1-(2-NAPHTHYL)METHANAMINERefChem:422566899-666-02018-90-82-Naphthalenemethanaminenaphthalen-2-ylmethanamine2-(Aminomethyl)naphthalene2-naphthylmethanamine2-AminomethylnaphthaleneMFCD01529867Naphthalen-2-methylamine(naphthalen-2-yl)methanamine

展开更多名称

2-萘甲胺萘-2-甲胺萘-2-基甲胺2-(氨甲基)萘1-(2-萘基)甲胺化合物 1-(2-NAPHTHYL)METHANAMINERARECHEM AL BW 0300Naphthyl methanamine1-(2-phthyl)methamineβ-Naphthalenemethylamine2-AMinoMethyl naphthalenenaphthalen-2-ylmethylamine1-(2-Naphthyl)methanamine, 95%

(naphthalene-2-yl)methylamineC-Naphthalen-2-yl-methylamine2-Aminomethylnapthalene2-naphthalenemethylamineCS-W002778AB01018358-012-naphthylmethylamine1-(NAPHTHALEN-2-YL)METHANAMINE

数据库标识

CAS: 2018-90-8
PubChem CID: 137282
DTXSID: DTXSID40174012
EC Number: 899-666-0
Nikkaji: J903.647D

性质

结构计算性质

XLogP: 2
极性表面积: 26 Å²
氢键供体: 1
氢键受体: 1
可旋转键: 1
重原子: 12
形式电荷: 0
复杂度: 144

物理化学性质

熔点: 59.5 °C · 59.5°C
沸点: 271.88 °C · 271.88°C (rough estimate)
密度: 1.0595 · 1.0595 (rough estimate)
折射率: 1.6722 · 1.6722 (estimate)
储存条件: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
形态: solid
酸度系数(pKa): 9.06 · 9.06±0.30(Predicted)
颜色: Yellow
InChI: InChI=1S/C11H11N/c12-8-9-5-6-10-3-1-2-4-11（10）7-9/h1-7H，8,12H2
InChIKey: XBCAHQUVHHHHHHL-UHFFFAOYSA-N
SMILES: C1=CC=C2C=C(C=CC2=C1)CN

安全与法规

GHS分类

GHS Classification · 4 条

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.