Basic information
- CAS
28399-43-1- Standard SMILES
CC(=O)OC1CCC2C3CCC4OC=CCC4(C)C3CCC12C- InChIKey
UWIQMSRDYMPREY-UHFFFAOYSA-N- Molecular formula
- C20H30O3
- Average molar mass
- 318.4 g/mol
- Monoisotopic mass
- 318.21949481
Names & identifiers
- Preferred name
- 4a,6a-Dimethyl-4,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydroindeno[5,4-f]chromen-7-yl acetate
- IUPAC
- (9a,11a-dimethyl-1,2,3,3a,3b,4,5,5a,9,9b,10,11-dodecahydroindeno[5,4-f]chromen-1-yl) acetate
Names & synonyms
28399-43-14a,6a-dimethyl-4,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydroindeno[5,4-f]chromen-7-yl acetateNSC109538DTXSID50296476NSC-1095384a,6a-Dimethyl-4,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydrocyclopenta[5,6]naphtho[2,1-b]pyran-7-yl acetate
Database identifiers
- CAS
28399-43-1- PubChem CID
- 269016
- DTXSID
DTXSID50296476
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 527
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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