Ethynyl Estradiol

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Catalog Number ACM57636-1
CAS 57-63-6
Structure {[CurrentData.Name]}
IUPAC Name (8R,9S,13S,14S,17R)-17-Ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
Synonyms Lynoral
Molecular Weight 296.41
Molecular Formula C20H24O2
Canonical SMILES CC12CCC3C(C1CCC2(C#C)O)CCC4=C3C=CC(=C4)O
Inchi InChI=1S/C20H24O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7,12,16-18,21-22H,4,6,8-11H2,2H3/t16-,17-,18+,19+,20+/m1/s1
InChIKey BFPYWIDHMRZLRN-SLHNCBLASA-N
Boiling Point 378 °C
Melting Point 182-183 °C(lit.)
Flash Point 9 °C
Purity 98%
Density 1.0944 g/cm³
Appearance Solid
Storage Room temperature

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