2-Aminotetralin

HCID 34677CAS 2954-50-9

部分構造検索類似構造を探す

基本情報

標準SMILES: NC1CCc2ccccc2C1
InChIKey: LCGFVWKNXLRFIF-UHFFFAOYSA-N
分子式: C10H13N
平均分子量: 147.22 g/mol
単同位体質量: 147.10479942

概要

1,2,3,4-tetrahydronaphthalen-2-amine is a member of tetralins.

名称と識別子

優先名称: 2-Aminotetralin
IUPAC: 1,2,3,4-tetrahydronaphthalen-2-amine

名称と別名

2954-50-91,2,3,4-Tetrahydro-2-naphthylamine2-AminotetralinLGX8T83G7XDTXSID10903058JGC-1273-aminotetralin3-aminotetralineRefChem:4652242-aminotetrahydronaphthalene2-Aminotetralin, (A+-)-DTXCID90973239

名称をさらに表示

220-973-71,2,3,4-tetrahydronaphthalen-2-amine2-Naphthalenamine, 1,2,3,4-tetrahydro-1,2,3,4-Tetrahydro-naphthalen-2-ylamine1,2,3,4-Tetrahydro-2-naphthalenamineMFCD00045577CHEMBL302941,2,3,4-tetrahydronaphthalen-2-ylamine hydrobromide

データベース識別子

CAS: 2954-50-9
PubChem CID: 34677
DTXSID: DTXSID10903058
ChEMBL: CHEMBL30294
ChEBI: CHEBI:125359
UNII: LGX8T83G7X
EC Number: 220-973-7
Nikkaji: J54.246F

物性

構造計算による物性

XLogP: 2.1
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: 0
重原子数: 11
形式電荷: 0
複雑度: 133

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (25%): 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)

Aggregated GHS information provided per 4 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.