CAS 85983-56-8 3-Fluoro-4-(piperidin-1-yl)aniline (HCID 6485758)

基本情報

CAS: 85983-56-8
標準SMILES: Nc1ccc(N2CCCCC2)c(F)c1
InChIKey: QBVOAZVDLKSGLR-UHFFFAOYSA-N
分子式: C11H15FN2
平均分子量: 194.25 g/mol
単同位体質量: 194.1219267

名称と識別子

優先名称: 3-Fluoro-4-(piperidin-1-yl)aniline
IUPAC: 3-fluoro-4-piperidin-1-ylaniline
現地名: 3-フルオロ-4-ピペリジン-1-イルフェニルアミン
英語名: 3-FLUORO-4-PIPERIDIN-1-YL-PHENYLAMINE
分子式: C11H15FN2
分子量: 194.25

名称と別名

3-fluoro-4-(piperidin-1-yl)anilineRefChem:501728848-123-685983-56-83-Fluoro-4-piperidin-1-yl-phenylamine3-fluoro-4-piperidin-1-ylanilineMFCD078012013-fluoro-4-piperidylphenylamine3-fluoro-4-piperidin-1-ylaniline dihydrochloride3-fluoro-4-piperidinoanilineSCHEMBL157935SCHEMBL28901605

名称をさらに表示

3-フルオロ-4-ピペリジン-1-イルフェニルアミンAKOS BB373AKOS B033505TIMTEC-BB SBB010917Benzenamine, 3-fluoro-4-(1-piperidinyl)-

SCHEMBL30721891DTXSID60424541QBVOAZVDLKSGLR-UHFFFAOYSA-N3-fluoro-4-(1-piperidyl)anilineALBB-0132703-fluoro-4-(1-piperidinyl)AnilineSBB010917STK346982

データベース識別子

CAS: 85983-56-8
PubChem CID: 6485758
DTXSID: DTXSID60424541
EC Number: 848-123-6

物性

構造計算による物性

XLogP: 2.3
極性表面積: 29.3 Å²
水素結合供与体数: 1
水素結合受容体数: 3
回転可能結合数: 1
重原子数: 14
形式電荷: 0
複雑度: 180

物理化学的性質

貯蔵温度: 2 · 2-8°C(protect from light)

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (100%): 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.