기본 정보
- CAS
1005095-16-8- 표준 SMILES
COc1cc(C2C(C(=O)OC(C)C)C(=O)CC(C)(O)C2C(=O)OC(C)C)ccc1O- InChIKey
FWDVEWRYQLATFP-UHFFFAOYSA-N- 분자식
- C22H30O8
- 평균 분자량
- 422.5 g/mol
- 단동위원소 질량
- 422.19406791
이름 및 식별자
- 우선 이름
- Dipropan-2-yl 4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
- IUPAC
- dipropan-2-yl 4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
이름 및 동의어
1005095-16-8dipropan-2-yl 4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate1,3-Bis(1-methylethyl) 4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-methyl-6-oxo-1,3-cyclohexanedicarboxylateOprea1_290313Oprea1_638081DTXSID201110341STL240065AKOS001686008AKOS022005659CCG-115040AT-057/13890110di(propan-2-yl) 4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
이름 더 보기
diisopropyl 4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-methyl-6-oxo-1,3-cyclohexanedicarboxylatediisopropyl 4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
데이터베이스 식별자
- CAS
1005095-16-8- PubChem CID
- 3133183
- DTXSID
DTXSID201110341
물성
구조 계산 물성
- XLogP
- 2.7
- 극성 표면적
- 119 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 645
관련 반응
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