1-(2-Methylpropyl)piperazine

HCID 2052052CAS 5308-28-1

기본 정보

표준 SMILES: CC(C)CN1CCNCC1
InChIKey: HUUQNWZMQSLPMX-UHFFFAOYSA-N
분자식: C8H18N2
평균 분자량: 142.24 g/mol
단동위원소 질량: 142.14699858

이름 및 식별자

우선 이름: 1-(2-Methylpropyl)piperazine
IUPAC: 1-(2-methylpropyl)piperazine
영어명: N-Isobutyl piperazine
분자식: C8H18N2
분자량: 142.24

이름 및 동의어

1-(2-methylpropyl)piperazineRefChem:422545673-561-81-isobutylpiperazine5308-28-1N-isobutylpiperazine1-isobutyl-piperazinen-isobutyl piperazineMFCD001905961-(2-Methylpropyl)-piperazinePiperazine, 1-(2-methylpropyl)-N-Isobutyliperazine

이름 더 보기

IFLAB-BB F1929-1684N-Isobutyl piperazine ISO 9001：2015 REACHN-iso-Butyl piperazine 1-iso-Butylpiperazine1-(2-METHYLPROPYL)-PIPERAZINE, 1-ISOBUTYL-PIPERAZINE

Isobutylpiperazin(2-methylpropyl)piperazineSCHEMBL208440SCHEMBL654972N-Isobutyl Piperazine Alias :SCHEMBL4376942SCHEMBL6198611SCHEMBL6199697

데이터베이스 식별자

CAS: 5308-28-1
PubChem CID: 2052052
DTXSID: DTXSID80366010
EC Number: 673-561-8

물성

구조 계산 물성

XLogP: 0.9
극성 표면적: 15.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 10
형식 전하: 0
복잡도: 85.3

물리화학적 성질

끓는 점: 65 °C · 65°C (10 mmHg)
밀도: 0.864 · 0.864±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C(protect from light)
산도 계수 (pKa): 9.27 · 9.27±0.10(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, 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 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.