기본 정보
- CAS
414909-98-1- 표준 SMILES
Cc1cc(F)ccc1C1CC(=O)C=CN1C(=O)OCc1ccccc1- InChIKey
DVPKLKJJGNAJRX-UHFFFAOYSA-N- 분자식
- C20H18FNO3
- 평균 분자량
- 339.4 g/mol
- 단동위원소 질량
- 339.1270716
이름 및 식별자
- 우선 이름
- benzyl 2-(4-fluoro-2-methylphenyl)-4-oxo-3,4-dihydropyridine-1(2H)-carboxylate
- IUPAC
- benzyl 2-(4-fluoro-2-methylphenyl)-4-oxo-2,3-dihydropyridine-1-carboxylate
- 영어명
- Benzyl 3,4-dihydro-2-(4-fluoro-2-methylphenyl)-4-oxopyridine-1(2H)-carboxylate, 1-[(Benzyloxy)carbonyl]-2-(4-fluoro-2-methylphenyl)-4-oxo-1,2,3,4-tetrahydropyridine
- 분자식
- C20H18FNO3
- 분자량
- 339.36
이름 및 동의어
414909-98-1benzyl 2-(4-fluoro-2-methylphenyl)-4-oxo-3,4-dihydropyridine-1(2H)-carboxylatebenzyl 2-(4-fluoro-2-methylphenyl)-4-oxo-2,3-dihydropyridine-1-carboxylate1(2H)-Pyridinecarboxylic acid,2-(4-fluoro-2-methylphenyl)-3,4-dihydro-4-oxo-, phenylmethyl ester1-Benzyloxycarbonyl-2-(4-fluoro-2-methylphenyl)-4-oxo-2,3-dihydro-1H-pyridineSCHEMBL2490272DTXSID10620233DVPKLKJJGNAJRX-UHFFFAOYSA-N2,3-DIHYDRO-2-(4-FLUORO-2-METHYLPHENYL)PYRIDIN-4(1H)-ONE, N-CBZ PROTECTEDDB-144411CS-02546011-benzyloxycarbonyl-2-(4-fluoro-2-methylphenyl)-4-oxo-3,4-dihydro-2H-pyridine
이름 더 보기
1-(Benzyloxycarbonyl)-2-(4-fluoro-2-methylphenyl)-2,3-dihydro-4-pyridonephenylmethyl 2-(4-fluoro-2-methylphenyl)-4-oxo-3,4-dihydro-1(2H)-pyridinecarboxylate1(2H)-Pyridinecarboxylic acid, 2-(4-fluoro-2-Methylphenyl)-3,4-dihydro-4-oxo-, phenylMethyl esterBENZYL 3,4-DIHYDRO-2-(4-FLUORO-2-METHYLPHENYL)-4-OXOPYRIDINE-1(2H)-CARBOXYLATE, 1-[(BENZYLOXY)CARBONBenzyl 3,4-dihydro-2-(4-fluoro-2-methylphenyl)-4-oxopyridine-1(2H)-carboxylate, 1-[(Benzyloxy)carbonyl]-2-(4-fluoro-2-methylphenyl)-4-oxo-1,2,3,4-tetrahydropyridine
2-(4-Fluoro-2-methyl-phenyl)-4-oxo-3,4-dihydro-2H-pyridine-1-carboxylic acid benzyl esterPhenylmethyl 2-(4-fluoro-2-methylphenyl)-3,4-dihydro-4-oxo-1(2h)-pyridinecarboxylate
데이터베이스 식별자
- CAS
414909-98-1- PubChem CID
- 21927686
- DTXSID
DTXSID10620233- EC Number
- 609-931-2
물성
구조 계산 물성
- XLogP
- 3.2
- 극성 표면적
- 46.6 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 25
- 형식 전하
- 0
- 복잡도
- 515
물리화학적 성질
- 끓는 점
- 493 · 493.0±45.0 °C(Predicted)
- 밀도
- 1 · 1+-.0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- -5.12 · -5.12±0.40(Predicted)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- HS 번호
- 2933399990
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