CAS 252006-26-1 2-(4-(4-Aminobutyl)piperazin-1-yl)ethan-1-ol (HCID 7138432)

기본 정보

CAS: 252006-26-1
표준 SMILES: NCCCCN1CCN(CCO)CC1
InChIKey: TUKFFSGMQJSJQQ-UHFFFAOYSA-N
분자식: C10H23N3O
평균 분자량: 201.31 g/mol

이름 및 식별자

우선 이름: 2-(4-(4-Aminobutyl)piperazin-1-yl)ethan-1-ol
IUPAC: 2-[4-(4-aminobutyl)piperazin-1-yl]ethanol
영어명: 2-[4-(4-aminobutyl)piperazin-1-yl]ethan-1-ol
분자식: C10H23N3O
분자량: 201.31

이름 및 동의어

2-[4-(4-aminobutyl)piperazin-1-yl]ethan-1-ol252006-26-12-(4-(4-Aminobutyl)piperazin-1-yl)ethan-1-olRefChem:456341987-024-32-[4-(4-aminobutyl)piperazin-1-yl]ethanol2-[4-(4-azanylbutyl)piperazin-1-yl]ethanol2-[4-(4-amino-butyl)-piperazin-1-yl]-ethanolSCHEMBL3090325TUKFFSGMQJSJQQ-UHFFFAOYSA-NCKA00626AKOS002670910

이름 더 보기

1-Piperazineethanol, 4-(4-aminobutyl)-

2-[4-(4-aminobutyl)-1-piperazinyl]ethanolCS-0261173EN300-77461Z406702122

데이터베이스 식별자

CAS: 252006-26-1
PubChem CID: 7138432
EC Number: 987-024-3

물성

구조 계산 물성

XLogP: -0.8
극성 표면적: 52.7 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 4
회전 가능 결합 수: 6
무거운 원자 수: 14
형식 전하: 0
복잡도: 135

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, 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.