2-アミノメチルナフタレン

1-(2-Naphthyl)methanamine

HCID 137282CAS 2018-90-8

部分構造検索類似構造を探す

基本情報

標準SMILES: NCc1ccc2ccccc2c1
InChIKey: XBCAHQUVHHVHHL-UHFFFAOYSA-N
分子式: C11H11N
平均分子量: 157.21 g/mol
単同位体質量: 157.08914935

名称と識別子

優先名称: 1-(2-Naphthyl)methanamine
IUPAC: naphthalen-2-ylmethanamine
現地名: 2-アミノメチルナフタレン
英語名: 1-(2-NAPHTHYL)METHANAMINE
分子式: C11H11N
分子量: 157.21

名称と別名

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

名称をさらに表示

2-アミノメチルナフタレンRARECHEM 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

データベース識別子

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

物性

構造計算による物性

XLogP: 2
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: 1
重原子数: 12
形式電荷: 0
複雑度: 144

物理化学的性質

融点: 59.5 °C · 59.5°C
沸点: 271.88 °C · 271.88°C (rough estimate)
比重(密度): 1.0595 · 1.0595 (rough estimate)
屈折率: 1.6722 · 1.6722 (estimate)
貯蔵温度: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
酸解離定数(Pka): 9.06 · 9.06±0.30(Predicted)
外見: solid
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

安全と法規制

GHS分類

GHS Classification · 4 件

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.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (50%)

安全データ

hs_code: 2921490090

化学と産業

応用分野

使用1-(2-Naphthyl)methanamine can be used as organic synthesis intermediates and pharmaceutical intermediates, mainly used in laboratory research and development and chemical production process.