1,3,5(10)-Estratrien-3,17-beta-diol dibenzoate
(3-benzoyloxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) benzoate
Also Known As: 1,3,5(10)-Estratrien-3,17-beta-diol dibenzoate|ESTRA-1,3,5(10)-TRIENE-3,17-BETA-DIYL DIBENZOATE|(3-benzoyloxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) benzoate
CAS: 4147-13-1
| Molecular Formula | C32H32O4 |
|---|---|
| Molecular Weight | 480.23007 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 480.23007 |
| Monoisotopic Mass | 480.23007 |
| Heavy Atoms | 36 |
| Complexity | 796.0 |
Chemical Identifiers
| CAS Number | 4147-13-1 |
|---|---|
| SMILES | CC12CCC3C(C1CCC2OC(=O)C4=CC=CC=C4)CCC5=C3C=CC(=C5)OC(=O)C6=CC=CC=C6 |
| InChIKey | QSEBTTYLHXQXSF-UHFFFAOYSA-N |
Product Overview
1,3,5(10)-Estratrien-3,17-beta-diol dibenzoate (CAS 4147-13-1), with molecular formula C32H32O4 and molecular weight 480.23007 g/mol. IUPAC: (3-benzoyloxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) benzoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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1,3,5(10)-Estratrien-3,17-beta-diol dibenzoate is a custom synthesis product. We offer services from milligram to kilogram scale.
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