Diethyl 2-(6-methoxy-1-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)-2-methylmalonate
기본 정보
- CAS
1225228-88-5- 표준 SMILES
CCOC(=O)C(C)(C(=O)OCC)C1CCc2cc(OC)ccc2C1=O- InChIKey
JEBMTTOXCCYUTJ-UHFFFAOYSA-N- 분자식
- C19H24O6
- 평균 분자량
- 348.4 g/mol
- 단동위원소 질량
- 348.15728848
이름 및 식별자
- 우선 이름
- Diethyl 2-(6-methoxy-1-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)-2-methylmalonate
- IUPAC
- diethyl 2-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2-methylpropanedioate
이름 및 동의어
1225228-88-5Diethyl 2-(6-methoxy-1-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)-2-methylmalonateDIETHYL 2-(6-METHOXY-1-OXO-1,2,3,4-TETRAHYDRO-NAPHTHALEN-2-YL)-2-METHYLMALONATEDiethyl2-(6-methoxy-1-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)-2-methylmalonatediethyl 2-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2-methylpropanedioateSCHEMBL2472482DTXSID50673061JEBMTTOXCCYUTJ-UHFFFAOYSA-NDB-342591Diethyl (6-methoxy-1-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)(methyl)propanedioatediethyl 2-methyl-2-(6-methoxy-1-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)malonate
데이터베이스 식별자
- CAS
1225228-88-5- PubChem CID
- 46194820
- DTXSID
DTXSID50673061
물성
구조 계산 물성
- XLogP
- 3.1
- 극성 표면적
- 78.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 25
- 형식 전하
- 0
- 복잡도
- 496
관련 반응
3건
화합물 노트
불러오는 중…