4-ESTREN-17-ALPHA-ETHYNYL-17-BETA-OL

About This Item

Molecular Formula	C₂₀H₂₈O
CAS Number	52-76-6

FC-0715429

Request a Quote Bulk Order Inquiry

Technical Service

Need help? Our experienced chemists are ready to assist you.

Let Us Assist →

Properties

Chemical Identifiers

IUPAC Name	(8R,9S,10R,13S,14S,17R)-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol
SMILES	CC12CCC3C(C1CCC2(C#C)O)CCC4=CCCCC34
InChI Key	YNVGQYHLRCDXFQ-XGXHKTLJSA-N
InChI	InChI=1S/C20H28O/c1-3-20(21)13-11-18-17-9-8-14-6-4-5-7-15(14)16(17)10-12-19(18,20)2/h1,6,15-18,21H,4-5,7-13H2,2H3/t15-,16+,17+,18-,19-,20-/m0/s1

Physical Properties

Boiling Point	399.6±42.0 °C at 760 mmHg
Melting Point	158-160 °C
Flash Point	176.9±20.9 °C
Density	1.1±0.1 g/cm3

Safety Information

Hazard Class

Danger

Flash Point

176.9±20.9 °C

Please refer to the Safety Data Sheet (SDS) for complete handling, storage, and disposal instructions. Follow all applicable regulations when working with this chemical reagent.