Methyl 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthrene-1-carboxylate
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기본 정보
- CAS
32208-29-0- 표준 SMILES
COC(=O)C1(C)CCCC2(C)C3CCC(C(C)C)CC3CCC12- InChIKey
FJHHBOWEISXQJX-UHFFFAOYSA-N- 분자식
- C21H36O2
- 평균 분자량
- 320.5 g/mol
이름 및 식별자
- 우선 이름
- Methyl 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthrene-1-carboxylate
- IUPAC
- methyl 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthrene-1-carboxylate
- 영어명
- 2,3,4,4b,5,6,7,8,8a,9,10,10a-Dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenecarboxylic acid methyl ester
- 분자식
- C21H36O2
- 분자량
- 320.51
이름 및 동의어
Podocarpan-15-oic acid, 13-isopropyl-, methyl ester3872-98-8methyl 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthrene-1-carboxylateSCHEMBL22981970FJHHBOWEISXQJX-UHFFFAOYSA-NNSC126264NSC-126264SY234545NS000487051-Phenanthrenecarboxylic acid,4a-dimethyl-7-(1-methylethyl)-, methyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,7.alpha.,8a.beta.,10a.alpha.)]-methyl 7-isopropyl-1,4a-dimethyl-2,3,4,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthrene-1-carboxylate1,4a-Dimethyltetradecahydro-7-(1-methylethyl)-1-phenanthrenecarboxylic acid methyl ester
이름 더 보기
1-Phenanthrenecarboxylic acid, tetradecahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester2,3,4,4b,5,6,7,8,8a,9,10,10a-Dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenecarboxylic acid methyl ester
데이터베이스 식별자
- CAS
32208-29-0- Nikkaji
- J108.524G
물성
구조 계산 물성보충 중
- XLogP
- 6.9
- 극성 표면적
- 26.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 23
- 형식 전하
- 0
- 복잡도
- 457
물리화학적 성질
- 끓는 점
- 351.9 · 351.9±10.0 °C(Predicted)
- 밀도
- 0.961 · 0.961±0.06 g/cm3(Predicted)
관련 반응
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