(3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) octanoate

CAS: 63042-22-8

Molecular Formula	`C26H38O3`
Molecular Weight	398.6 g/mol
LogP	7.6
Topological Polar Surface Area	46.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	8
Exact Mass	398.2821
Heavy Atoms	29
Complexity	560.0

Chemical Identifiers

CAS Number	63042-22-8
SMILES	`CCCCCCCC(=O)OC1CCC2C1(CCC3C2CCC4=C3C=CC(=C4)O)C`
InChIKey	`VJJJFYBJSXJBPB-UHFFFAOYSA-N`

📖 Product Overview

(3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) octanoate (CAS: 63042-22-8) is a chemical compound with molecular formula C26H38O3 and molecular weight 398.6 g/mol. Its IUPAC systematic name is (3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) octanoate. LogP 7.6 Topological Polar Surface Area 46.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 8 Exact Mass 398.2821 Heavy Atoms 29 Complexity 560.0 InChI Key: VJJJFYBJSXJBPB-UHFFFAOYSA-N. SMILES: CCCCCCCC(=O)OC1CCC2C1(CCC3C2CCC4=C3C=CC(=C4)O)C.

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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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📚 Academic Support

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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for (3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) octanoate.

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