1-(3,5-디메틸페닐)피페라진

1-(3,5-Dimethylphenyl)piperazine

HCID 2758626

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 105907-65-1
표준 SMILES: Cc1cc(C)cc(N2CCNCC2)c1
InChIKey: RBSSPJDOINFUCR-UHFFFAOYSA-N
분자식: C12H18N2
평균 분자량: 190.28 g/mol
단동위원소 질량: 190.14699858

이름 및 식별자

우선 이름: 1-(3,5-Dimethylphenyl)piperazine
IUPAC: 1-(3,5-dimethylphenyl)piperazine
현지명: 1-(3,5-디메틸페닐)피페라진
영어명: 1-(3,5-Dimethylphenyl)piperazine
분자식: C12H18N2
분자량: 190.28

이름 및 동의어

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

이름 더 보기

1-(3,5-디메틸페닐)피페라진Piperazine,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

데이터베이스 식별자

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

물성

구조 계산 물성

XLogP: 2.1
극성 표면적: 15.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 14
형식 전하: 0
복잡도: 165

물리화학적 성질

저장 조건: -20 °C · Store at -20°C
용해도: 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
물리적 상태: 결정성 고체

안전 및 규제

GHS 분류

GHS Classification · 4건

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.