N-메틸-2-피롤리딘-1-일-에탄아민

Methyl(2-(pyrrolidin-1-yl)ethyl)amine

HCID 295976CAS 32776-22-0

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CNCCN1CCCC1
InChIKey: GYGYDOOXVKDZCF-UHFFFAOYSA-N
분자식: C7H16N2
평균 분자량: 128.22 g/mol
단동위원소 질량: 128.13134851

이름 및 식별자

우선 이름: Methyl(2-(pyrrolidin-1-yl)ethyl)amine
IUPAC: N-methyl-2-pyrrolidin-1-ylethanamine
현지명: N-메틸-2-피롤리딘-1-일-에탄아민
영어명: N-methyl-2-pyrrolidin-1-yl-ethanamine
분자식: C7H16N2
분자량: 128.22

이름 및 동의어

methyl[2-(pyrrolidin-1-yl)ethyl]amineMethyl(2-(pyrrolidin-1-yl)ethyl)amineRefChem:818370829-385-032776-22-0N-methyl-2-pyrrolidin-1-ylethanamineN-methyl-2-(pyrrolidin-1-yl)ethanaminemethyl-(2-pyrrolidin-1-yl-ethyl)-amineN-methyl-2-pyrrolidin-1-yl-ethanamineMFCD080597661-Pyrrolidineethanamine,N-methyl-N-methyl-2-(pyrrolidin-1-yl)ethan-1-amine

이름 더 보기

N-메틸-2-피롤리딘-1-일-에탄아민N-Methyl-2-(pyrrolidin-1-yl)ethanamine 2HClN-Methyl-N-(2-pyrrolidin-1-ylethyl)amineN-methyl-2-pyrrolidin-1-ylethanamine dihydrochlorideN-methyl-2-pyrrolidin-1-ylethanamine(SALTDATA: FREE)

CHEMBL4445795methyl(2-pyrrolidinylethyl)amineN-methyl-2-(1-pyrrolidinyl)ethanamine1-Pyrrolidineethanamine, N-methyl-NSC165662SCHEMBL474947SCHEMBL474948SCHEMBL2076864

데이터베이스 식별자

CAS: 32776-22-0
PubChem CID: 295976
DTXSID: DTXSID60304415
ChEMBL: CHEMBL4445795
EC Number: 829-385-0

물성

구조 계산 물성

XLogP: 0.6
극성 표면적: 15.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 3
무거운 원자 수: 9
형식 전하: 0
복잡도: 67.3

물리화학적 성질

끓는 점: 171.7 · 171.7±8.0 °C(Predicted)
밀도: 0.898 · 0.898±0.06 g/cm3(Predicted)
산도 계수 (pKa): 10.49 · 10.49±0.10(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H227 (100%): Combustible liquid [Warning Flammable liquids]

P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.