CAS 5004-94-4 4-Phenylpiperidin-4-ol hydrochloride (HCID 18614383)

基本情報

CAS: 5004-94-4
標準SMILES: Cl.OC1(c2ccccc2)CCNCC1
InChIKey: SETKGOFWOWUIIE-UHFFFAOYSA-N
分子式: C11H16ClNO
平均分子量: 213.7 g/mol
単同位体質量: 213.09204181

名称と識別子

優先名称: 4-Phenylpiperidin-4-ol hydrochloride
IUPAC: 4-phenylpiperidin-4-ol;hydrochloride
現地名: 4-ヒドロキシ-4-フェニルピペリジン塩酸塩
英語名: 4-Phenyl-4-piperidinol HCl
分子式: C11H16ClNO
分子量: 213.70384

名称と別名

4-phenylpiperidin-4-ol hydrochloride5004-94-4RefChem:526441849-433-44-Hydroxy-4-phenylpiperidine hydrochloride4-phenylpiperidin-4-ol;hydrochlorideMFCD216053334-Phenyl-4-piperidinol HCl4-Phenyl-4-piperidinol hydrochloride4-Phenyl-4-hydroxypiperidine; 4-Phenyl-4-piperidinol Hydrochloride; NSC 71658 Hydrochloride; 1,4'-Bipiperidin]-4'-ol Hydrochloride;4-piperidinol,4-phenyl-,hydrochlorideorb3026168

名称をさらに表示

4-ヒドロキシ-4-フェニルピペリジン塩酸塩4-Piperidinol, 4-phenyl-, hydrochloride

SCHEMBL57299654-phenyl-4-hydroxypiperidine HClSETKGOFWOWUIIE-UHFFFAOYSA-NDTXSID3013571164-Phenyl-4-piperidinolhydrochlorideFAA00494TD1422AS-93876

データベース識別子

CAS: 5004-94-4
PubChem CID: 18614383
DTXSID: DTXSID301357116
EC Number: 849-433-4

物性

構造計算による物性

極性表面積: 32.3 Å²
水素結合供与体数: 3
水素結合受容体数: 2
回転可能結合数: 1
重原子数: 14
形式電荷: 0
複雑度: 157

物理化学的性質

貯蔵温度: Store at Room Tem.
溶解性: soluble in DMSO, Methanol
外見: Solid
色: Yellow

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.