2-아미노-1,1-디메틸에틸이소프로필아민

2-Amino-1,1-dimethylethylisopropylamine

HCID 79532CAS 5448-29-3

기본 정보

표준 SMILES: CC(C)NCC(C)(C)N
InChIKey: BVVNMQQFLWWRFT-UHFFFAOYSA-N
분자식: C7H18N2
평균 분자량: 130.23 g/mol
단동위원소 질량: 130.14699858

개요

N(1)-isopropyl-2-methylpropan-1,2-diamine is a primary aliphatic amine that is propan-1,2-diamine substituted by an isopropyl group at N1 and a methyl group at position 2. Metabolite observed in cancer metabolism. It has a role as a human metabolite. It is a primary aliphatic amine and a secondary aliphatic amine.

이름 및 식별자

우선 이름: 2-Amino-1,1-dimethylethylisopropylamine
IUPAC: 2-methyl-1-N-propan-2-ylpropane-1,2-diamine
현지명: 2-아미노-1,1-디메틸에틸이소프로필아민
영어명: 2-amino-1,1-dimethylethylisopropylamine
분자식: C7H18N2
분자량: 130.23

이름 및 동의어

5448-29-32-Amino-1,1-dimethylethylisopropylamine(2-amino-2-methylpropyl)(propan-2-yl)amineXY2CCA73SX2-methyl-1-N-propan-2-ylpropane-1,2-diamine1,2-Propanediamine, 2-methyl-N1-(1-methylethyl)-N(1)-isopropyl-2-methylpropan-1,2-diamineEINECS 226-671-1NSC 17712NSC-17712N1-Isopropyl-2-methyl-1,2-propanediamineAI3-28056

이름 더 보기

2-아미노-1,1-디메틸에틸이소프로필아민2-Methyl-N-isopropyl-1,2-propanediamine

CHEBI:842652-AMINO-1-ISOPROPYLAMINO-2-METHYLPROPANEN1-ISOPROPYL-1,2-DIAMINO-2-METHYLPROPANE2-methyl-N(1)-(propan-2-yl)propane-1,2-diamine2-METHYL-N1-(1-METHYLETHYL)-1,2-PROPANEDIAMINERefChem:85027226-671-1N1-Isopropyl-2-methylpropane-1,2-diamine

데이터베이스 식별자

CAS: 5448-29-3
PubChem CID: 79532
DTXSID: DTXSID10969654
ChEBI: CHEBI:84265
UNII: XY2CCA73SX
EC Number: 226-671-1
Nikkaji: J210.493H

물성

구조 계산 물성

XLogP: 0.3
극성 표면적: 38.1 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 3
무거운 원자 수: 9
형식 전하: 0
복잡도: 77

실험 및 물리화학적 성질

SpringerMaterials Properties15N nuclear magnetic resonance spectrum

화학 및 산업

상·하류 제품 정보

상류 원료

1-Propanamine, 2-methyl-N-(1-methylethyl)-2-nitro-2-Propanamine, N-(2-chloro-2-methylpropylidene)-, [N(E)]-

공급사2 곳

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]

DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

추가 설명

정의ChEBI: A primary aliphatic amine that is propan-1,2-diamine substituted by an isopropyl group at N1 and a methyl group at position 2. Metabolite observed in cancer metabolism.