Diethyl 2-(2,2,7-trimethyl-1-propanoyl-3-sulfanylidenequinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate
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기본 정보
- CAS
354991-77-8- 표준 SMILES
CCOC(=O)C1=C(C(=O)OCC)SC(=C2C(=S)C(C)(C)N(C(=O)CC)c3cc(C)ccc32)S1- InChIKey
VGXQYAAMQSXYDF-UHFFFAOYSA-N- 분자식
- C24H27NO5S3
- 평균 분자량
- 505.7 g/mol
- 단동위원소 질량
- 505.10513648
이름 및 식별자
- 우선 이름
- Diethyl 2-(2,2,7-trimethyl-1-propanoyl-3-sulfanylidenequinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate
- IUPAC
- diethyl 2-(2,2,7-trimethyl-1-propanoyl-3-sulfanylidenequinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate
- 영어명
- diethyl 2-(2,2,7-trimethyl-1-propionyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylate
- 분자식
- C24H27NO5S3
- 분자량
- 505.67
이름 및 동의어
354991-77-8diethyl 2-(2,2,7-trimethyl-1-propanoyl-3-sulfanylidenequinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylateSTK006464AKOS002229849ST50103659AJ-292/13095203diethyl 2-(2,2,7-trimethyl-1-propanoyl-3-sulfanylidene-2,3-dihydroquinolin-4(1H)-ylidene)-2H-1,3-dithiole-4,5-dicarboxylatediethyl 2-(2,2,7-trimethyl-1-propanoyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylatediethyl 2-(2,2,7-trimethyl-1-propionyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylatediethyl 2-(2,2,7-trimethyl-1-propionyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylateethyl 5-(ethoxycarbonyl)-2-(2,2,7-trimethyl-1-propanoyl-3-thioxo(4-1,2-dihydro quinolylidene))-1,3-dithiolene-4-carboxylate1,3-Dithiole-4,5-dicarboxylic acid, 2-[2,3-dihydro-2,2,7-trimethyl-1-(1-oxopropyl)-3-thioxo-4(1H)-quinolinylidene]-, 4,5-diethyl ester
데이터베이스 식별자
- CAS
354991-77-8- PubChem CID
- 2873518
물성
구조 계산 물성보충 중
- XLogP
- 5
- 극성 표면적
- 156 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 33
- 형식 전하
- 0
- 복잡도
- 891
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