1-(5-클로로-2-메틸페닐)피페라진

N-(5-Chloro-2-methylphenyl)piperazine

HCID 693767

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 76835-20-6
표준 SMILES: Cc1ccc(Cl)cc1N1CCNCC1
InChIKey: FVDJRHNUZNLRJC-UHFFFAOYSA-N
분자식: C11H15ClN2
평균 분자량: 210.7 g/mol
단동위원소 질량: 210.09237616

이름 및 식별자

우선 이름: N-(5-Chloro-2-methylphenyl)piperazine
IUPAC: 1-(5-chloro-2-methylphenyl)piperazine
현지명: 1-(5-클로로-2-메틸페닐)피페라진
영어명: 1-(5-Chloro-2-methylphenyl)piperazine
분자식: C11H15ClN2
분자량: 210.7

이름 및 동의어

1-(5-chloro-2-methylphenyl)piperazine76835-20-6Piperazine, 1-(5-chloro-2-methylphenyl)-N-(5-Chloro-2-methylphenyl)piperazineZTJ246H8JVEINECS 278-560-24-(2-methyl-5-chlorophenyl)piperazine1-(5-Chloro-o-tolyl)piperazineDTXSID80227652RefChem:828139DTXCID30150143278-560-2

이름 더 보기

1-(5-클로로-2-메틸페닐)피페라진AKOS BBS-00003583TIMTEC-BB SBB003438LABOTEST-BB LTBB000768N-(5-CHLORO-2-METHYLPHENYL)-PIPERAZINE1-(5-Chloro-2-methylphenyl)-piperazine,98%1-(5-Chloro-2-methylphenyl)piperazine ,97.5%1-(5-Chloro-2-Methylphenyl)-piperazine, 98% 50GR

Piperazine,1-(5-chloro-2-methylphenyl)-MFCD00087128UNII-ZTJ246H8JVEN300-18966(5-chloro-2-methylphenyl)piperazine1-(5-chloro-2-methylphenyl)-piperazine1-(5-chloro-2-methyl-phenyl)piperazineOprea1_678325

데이터베이스 식별자

CAS: 76835-20-6
PubChem CID: 693767
DTXSID: DTXSID80227652
ChEMBL: CHEMBL5489631
UNII: ZTJ246H8JV
EC Number: 278-560-2
Nikkaji: J267.444K

물성

구조 계산 물성

XLogP: 2.8
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: 180

물리화학적 성질

끓는 점: 342.56 °C · 342.56°C (rough estimate)
밀도: 1.1197 · 1.1197 (rough estimate)
굴절률: 1.573 · 1.573-1.576
저장 조건: Store at Room Tem.
산도 계수 (pKa): 8.85 · 8.85±0.10(Predicted)

화학적 성질

clear colourless to light yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, 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.