기본 정보
- 표준 SMILES
COC(=O)c1ccc(C#CCNC(=O)OC(C)(C)C)o1- InChIKey
FDSOSIXZTNVTQJ-UHFFFAOYSA-N- 분자식
- C14H17NO5
- 평균 분자량
- 279.29 g/mol
- 단동위원소 질량
- 279.11067264
이름 및 식별자
- 우선 이름
- Methyl 5-(3-((tert-butoxycarbonyl)amino)prop-1-yn-1-yl)furan-2-carboxylate
- IUPAC
- methyl 5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]prop-1-ynyl]furan-2-carboxylate
이름 및 동의어
223461-83-4Methyl 5-(3-((tert-butoxycarbonyl)amino)prop-1-yn-1-yl)furan-2-carboxylateMFCD24467219methyl 5-(3-{[(tert-butoxy)carbonyl]amino}prop-1-yn-1-yl)furan-2-carboxylatemethyl 5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]prop-1-ynyl]furan-2-carboxylateSCHEMBL5724967FDSOSIXZTNVTQJ-UHFFFAOYSA-NAKOS027256014AS-73166SY124734CS-0037890W12261
이름 더 보기
Methyl 5-[3-(Boc-amino)-1-propyn-1-yl]furan-2-carboxylateMethyl 5-(3-((t-butoxycarbonyl)amino)prop-1-yn-1-yl)furan-2-carboxylatemethyl 5-[3-(tert-butoxycarbonylamino)prop-1-ynyl]furan-2-carboxylateMethyl5-(3-((tert-butoxycarbonyl)amino)prop-1-yn-1-yl)furan-2-carboxylate5-(3-tert-butoxycarbonylamino-prop-1-ynyl)-furan-2-carboxylic acid methyl esterMethyl 5-(3-((Tert-Butoxycarbonyl)Amino)Prop-1-Yn-1-Yl)Furan-2-Carboxylate(WXC03272)2-Furancarboxylic acid, 5-[3-[[(1,1-dimethylethoxy)carbonyl]amino]-1-propyn-1-yl]-, methyl ester
데이터베이스 식별자
- PubChem CID
- 53793873
물성
구조 계산 물성
- XLogP
- 2.1
- 극성 표면적
- 77.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 20
- 형식 전하
- 0
- 복잡도
- 426
관련 반응
7건
화합물 노트
불러오는 중…