estradiol diacetate

[(8R,9S,13S,14S,17S)-3-acetyloxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] acetate

CAS: 3434-88-6

Molecular Formula	`C22H28O4`
Molecular Weight	356.5 g/mol
LogP	3.4
Topological Polar Surface Area	52.6 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	4
Exact Mass	356.19876
Heavy Atoms	26
Complexity	572.0

Chemical Identifiers

CAS Number	3434-88-6
SMILES	`CC(=O)OC1CCC2C1(CCC3C2CCC4=C3C=CC(=C4)OC(=O)C)C`
InChIKey	`VQHQLBARMFAKSV-AANPDWTMSA-N`

📖 Product Overview

estradiol diacetate (CAS: 3434-88-6) is a chemical compound with molecular formula C22H28O4 and molecular weight 356.5 g/mol. Its IUPAC systematic name is [(8R,9S,13S,14S,17S)-3-acetyloxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] acetate. LogP 3.4 Topological Polar Surface Area 52.6 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 4 Exact Mass 356.19876 Heavy Atoms 26 Complexity 572.0 InChI Key: VQHQLBARMFAKSV-AANPDWTMSA-N. SMILES: CC(=O)OC1CCC2C1(CCC3C2CCC4=C3C=CC(=C4)OC(=O)C)C.

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