기본 정보
- CAS
474645-94-8- 표준 SMILES
CCOC(=O)N1c2ccc(C(F)(F)F)cc2[C@@H](NC(=O)OC)C[C@H]1CC- InChIKey
SEYVRRKNFKPZAE-YPMHNXCESA-N- 분자식
- C17H21F3N2O4
- 평균 분자량
- 374.35 g/mol
- 단동위원소 질량
- 374.14534164
이름 및 식별자
- 우선 이름
- (2R, 4S)-2-ethyl-4-methoxycarbonylamino-6-trifluoromethyl-3,4-dihydro-2H-quinoline-1-carboxylic acid ethyl ester
- IUPAC
- ethyl (2R,4S)-2-ethyl-4-(methoxycarbonylamino)-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carboxylate
- 영어명
- (2R,4S)-2-Ethyl-4-methoxycarbonylamino-6-trifluoromethyl-3,4-dihydro-2H-quinoline-1-carboxylic Acid Ethyl Ester
- 분자식
- C17H21F3N2O4
- 분자량
- 374.35
이름 및 동의어
474645-94-8DTXSID40435892(2R, 4S)-2-ethyl-4-methoxycarbonylamino-6-trifluoromethyl-3,4-dihydro-2H-quinoline-1-carboxylic acid ethyl esterRefChem:206700DTXCID80386718(2R,4S)-2-Ethyl-4-methoxycarbonylamino-6-trifluoromethyl-3,4-dihydro-2H-quinoline-1-carboxylic Acid Ethyl Esterethyl (2R,4S)-2-ethyl-4-(methoxycarbonylamino)-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carboxylateEthyl (2R,4S)-2-ethyl-4-((methoxycarbonyl)amino)-6-(trifluoromethyl)-3,4-dihydroquinoline-1(2H)-carboxylateEthyl (2R,4S)-2-ethyl-4-[(methoxycarbonyl)amino]-6-(trifluoromethyl)-3,4-dihydroquinoline-1(2H)-carboxylateDB-309767(2R. 4S)-2-Ethyl-4-methoxycarbonylamino-6-trifluoromethyl-3,4-dihydro-2H-quinoline-1-carboxylic acid ethyl ester(2R,4S)-2-Ethyl-3,4-dihydro-4-[(Methoxycarbonyl)aMino]-6-(trifluoroMethyl)-1(2H)-quinolinecarboxylic Acid Ethyl Ester
이름 더 보기
1(2H)-Quinolinecarboxylic acid, 2-ethyl-3,4-dihydro-4-[(methoxycarbonyl)amino]-6-(trifluoromethyl)-, ethyl ester, (2R,4S)-
물성
구조 계산 물성
- XLogP
- 3.6
- 극성 표면적
- 67.9 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 515
물리화학적 성질
- 용해도
- 클로로포름, 디클로로메탄, 에틸아세테이트에 용해됨
- 물리적 상태
- 고체
- 색상
- 하얀색
화학적 성질
White Solid
화학 및 산업
응용 분야
용도Torcetrapib intermediate.
공급사5 곳
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