CAS 105907-65-1 1-(3,5-Dimethylphenyl)piperazine (HCID 2758626)

基本情報

CAS: 105907-65-1
標準SMILES: Cc1cc(C)cc(N2CCNCC2)c1
InChIKey: RBSSPJDOINFUCR-UHFFFAOYSA-N
分子式: C12H18N2
平均分子量: 190.28 g/mol
単同位体質量: 190.14699858

名称と識別子

優先名称: 1-(3,5-Dimethylphenyl)piperazine
IUPAC: 1-(3,5-dimethylphenyl)piperazine
現地名: 1-(3,5-ジメチルフェニル)ピペラジン
英語名: 1-(3,5-Dimethylphenyl)piperazine
分子式: C12H18N2
分子量: 190.28

名称と別名

1-(3,5-dimethylphenyl)piperazine105907-65-1DTXSID70374422RefChem:224097DTXCID103254531-(3,5-Dimethylphenyl)-piperazineMFCD030956391-(3,5-dimethyl-phenyl)-piperazinePIPERAZINE, 1-(3,5-DIMETHYLPHENYL)-1-(3,5-xylyl)piperazine(3,5-dimethylphenyl)piperazineSCHEMBL1138607

名称をさらに表示

1-(3,5-ジメチルフェニル)ピペラジンPiperazine,1-(3,5-dimethylphenyl)-Piperazine, 1-(3,5-dimethylphenyl)- (9CI)1-(3,5-dimethylphenyl)piperazine hydrochloride

SCHEMBL6588911RBSSPJDOINFUCR-UHFFFAOYSA-N1-(3,5-dimethyl phenyl)piperazine1-(3,5-dimethylphenyl) piperazineGS1638AKOS009097887AB13759FS-1576

データベース識別子

CAS: 105907-65-1
PubChem CID: 2758626
DTXSID: DTXSID70374422
EC Number: 673-638-6

物性

構造計算による物性

XLogP: 2.1
極性表面積: 15.3 Å²
水素結合供与体数: 1
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: 165

物理化学的性質

貯蔵温度: -20 °C · Store at -20°C
溶解性: 30 mg/ml; · DMF: 30 mg/ml; DMF:PBS(pH7.2) (1:2): 0.33 mg/ml; DMSO: 30 mg/ml; Ethanol: 30 mg/ml
外見: A crystalline solid

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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.