Compound C18H23BrO2

(8R,9S,13S,14S,16R,17R)-16-bromo-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol

CAS: 54982-79-5

Molecular Formula	`C18H23BrO2`
Molecular Weight	351.3 g/mol
LogP	3.9
Topological Polar Surface Area	40.5 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	2
Rotatable Bonds	0
Exact Mass	350.08813
Heavy Atoms	21
Complexity	414.0

Chemical Identifiers

CAS Number	54982-79-5
SMILES	`CC12CCC3C(C1CC(C2O)Br)CCC4=C3C=CC(=C4)O`
InChIKey	`ICCJJRSEGGYXMX-ZXXIGWHRSA-N`

📖 Product Overview

Compound C18H23BrO2 (CAS: 54982-79-5) is a chemical compound with molecular formula C18H23BrO2 and molecular weight 351.3 g/mol. Its IUPAC systematic name is (8R,9S,13S,14S,16R,17R)-16-bromo-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol. LogP 3.9 Topological Polar Surface Area 40.5 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 2 Rotatable Bonds 0 Exact Mass 350.08813 Heavy Atoms 21 Complexity 414.0 InChI Key: ICCJJRSEGGYXMX-ZXXIGWHRSA-N. SMILES: CC12CCC3C(C1CC(C2O)Br)CCC4=C3C=CC(=C4)O.

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