4-[(1-メチルピペリジン-4-イル)メトキシ]アニリン

4-((1-Methyl-4-piperidinyl)methoxy)benzenamine

HCID 11564798

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 902454-26-6
標準SMILES: CN1CCC(COc2ccc(N)cc2)CC1
InChIKey: WZRKMUXDLMLRJV-UHFFFAOYSA-N
分子式: C13H20N2O
平均分子量: 220.31 g/mol
単同位体質量: 220.15756326

名称と識別子

優先名称: 4-((1-Methyl-4-piperidinyl)methoxy)benzenamine
IUPAC: 4-[(1-methylpiperidin-4-yl)methoxy]aniline
現地名: 4-[(1-メチルピペリジン-4-イル)メトキシ]アニリン
英語名: 4-[(1-METHYL-4-PIPERIDINYL)METHOXY]BENZENAMINE
分子式: C13H20N2O
分子量: 220.31

名称と別名

902454-26-64-[(1-METHYL-4-PIPERIDINYL)METHOXY]BENZENAMINE4-((1-Methyl-4-piperidinyl)methoxy)benzenamineRefChem:2862684-((1-Methylpiperidin-4-yl)methoxy)aniline4-[(1-Methylpiperidin-4-yl)methoxy]aniline4-(1-methyl-4-piperidinylmethoxy)anilineMFCD099096284-[(1-methyl-4-piperidyl)methoxy]aniline4-((1-Methylpiperidin-4-yl)methoxy)phenylamineSCHEMBL1674238DTXSID70468673

名称をさらに表示

4-[(1-メチルピペリジン-4-イル)メトキシ]アニリン4-(1-Methyl-4-piperidinylMethoxy)aniline, 96%4-[(1-METHYLPIPERIDINE-4-YL)METHOXY]PHENYLAMINEBenzenamine, 4-[(1-methyl-4-piperidinyl)methoxy]-

WZRKMUXDLMLRJV-UHFFFAOYSA-NAKOS022175217KS-5641CS-03304144-(1-methyl-piperidin-4-ylmethoxy)-phenylamine4-(1-Methyl-4-piperidinylmethoxy)aniline, >96%4-(1-Methyl-piperidin-4-ylmethoxy)-phenyl amineF063731

データベース識別子

CAS: 902454-26-6
PubChem CID: 11564798
DTXSID: DTXSID70468673
EC Number: 678-663-6

物性

構造計算による物性

XLogP: 2
極性表面積: 38.5 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: 3
重原子数: 16
形式電荷: 0
複雑度: 194

物理化学的性質

CAS データベース: 902454 · 902454-26-6

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, P317, P321, P330, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.