1-Methyl-4-(piperidin-4-yl)piperazine

HCID 795707

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 53617-36-0
표준 SMILES: CN1CCN(C2CCNCC2)CC1
InChIKey: MRYYJGQKVGZGSB-UHFFFAOYSA-N
분자식: C10H21N3
평균 분자량: 183.29 g/mol
단동위원소 질량: 183.17354767

이름 및 식별자

우선 이름: 1-Methyl-4-(piperidin-4-yl)piperazine
IUPAC: 1-methyl-4-piperidin-4-ylpiperazine
영어명: 1-METHYL-4-(PIPERIDIN-4-YL)-PIPERAZINE
분자식: C10H21N3.C2H4O2
분자량: 243.35

이름 및 동의어

1-Methyl-4-(piperidin-4-yl)piperazine53617-36-0DTXSID30912521RefChem:434353DTXCID201341538679-454-21-methyl-4-(4-piperidinyl)piperazine1-Methyl-4-(piperidin-4-yl)-piperazine1-methyl-4-piperidin-4-ylpiperazine1-Methyl-4-piperidin-4-yl-piperazineC10H21N3MFCD03274729

이름 더 보기

TIMTEC-BB SBB0101831-methyl-4-(4-piperidinyl)piperazine monoacetate

99726-99-51-methyl-4-(4-piperidyl)piperazineEN300-3650334-methyl-1-(4-piperidyl)piperazinePiperazine, 1-methyl-4-(4-piperidinyl)-1-Methyl-4-(4-piperidino)piperazine1 Methyl-4-(piperidin-4-yl)piperazineBrigatinib RC 1 (Base)

데이터베이스 식별자

CAS: 53617-36-0、99726-99-5
PubChem CID: 795707
DTXSID: DTXSID30912521
EC Number: 673-024-8、679-454-2
Nikkaji: J2.867.589E

물성

구조 계산 물성

XLogP: 0.2
극성 표면적: 18.5 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: 0
복잡도: 146

물리화학적 성질

녹는점: 56 · 56-57°C

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H314 (17.3%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P332+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 52 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Warning

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