(1S,4S)-4-(2,5-dimethyl-1H-pyrrol-1-yl)-1-isopropylcyclopent-2-enecarboxylic acid
기본 정보
- CAS
851916-39-7- 표준 SMILES
Cc1ccc(C)n1[C@@H]1C=C[C@@](C(=O)O)(C(C)C)C1- InChIKey
YXAJQLUEPZZFJT-HIFRSBDPSA-N- 분자식
- C15H21NO2
- 평균 분자량
- 247.33 g/mol
이름 및 식별자
- 우선 이름
- (1S,4S)-4-(2,5-dimethyl-1H-pyrrol-1-yl)-1-isopropylcyclopent-2-enecarboxylic acid
- IUPAC
- (1S,4S)-4-(2,5-dimethylpyrrol-1-yl)-1-propan-2-ylcyclopent-2-ene-1-carboxylic acid
- 영어명
- (1S,4S)-4-(2,5-diMethyl-1H-pyrrol-1-yl)-1-(propan-2-yl)cyclopent-2-ene-1-carboxylic acid
- 분자식
- C15H21NO2
- 분자량
- 247.33
이름 및 동의어
(1S,4S)-4-(2,5-dimethyl-1H-pyrrol-1-yl)-1-isopropylcyclopent-2-enecarboxylic acid851916-39-7(1S,4S)-4-(2,5-dimethylpyrrol-1-yl)-1-propan-2-ylcyclopent-2-ene-1-carboxylic acidSCHEMBL1964495YXAJQLUEPZZFJT-HIFRSBDPSA-NAKOS015924662DB-353248E80316(1S,4S)-4-(2,5-dimethyl-1H-pyrrol-1-yl)-1-isopropylcyclopent-2-ene-1-carboxylic acid(1S,4S)-4-(2,5-dimethyl-1H-pyrrol-1-yl)1-isopropylcyclopent-2-ene-1-carboxylic acid(1S,4S)-4-(2,5-Dimethyl-1H-pyrrol-1-yl)-1-isopropyl-2-cyclopenten e-1-carboxylic acid(1S,4S)-4-(2,5-diMethyl-1H-pyrrol-1-yl)-1-(propan-2-yl)cyclopent-2-ene-1-carboxylic acid
이름 더 보기
2-Cyclopentene-1-carboxylic acid, 4-(2,5-dimethyl-1H-pyrrol-1-yl)-1-(1-methylethyl)-, (1S,4S)-
데이터베이스 식별자
- CAS
851916-39-7
물성
구조 계산 물성
- XLogP
- 3
- 극성 표면적
- 42.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 354
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