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17alpha-Dihydroequilin
[CAS# 6639-99-2]

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Identification
Name 17alpha-Dihydroequilin
Synonyms .Alpha.-Dihydroequilenina; .Alpha.-Estra-1,3,5,7,9-Pentaen-3,17-Diol; Estra-1,3,5(10),6,8-Pentaene-3,17-Diol, (17.Alpha.)-
Molecular Structure CAS#: 6639-99-2, 17alpha-Dihydroequilin
Molecular Formula C18H20O2
Molecular Weight 268.35
CAS Registry Number 6639-99-2
EINECS 229-650-5
SMILES [C@H]12[C@@]([C@H](O)CC1)(CCC3=C4C(=CC=C23)C=C(O)C=C4)C
InChI 1S/C18H20O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h2-5,10,16-17,19-20H,6-9H2,1H3/t16-,17+,18-/m0/s1
InChIKey RYWZPRVUQHMJFF-KSZLIROESA-N
Properties
Density 1.249g/cm3 (Cal.)
Boiling point 472.468°C at 760 mmHg (Cal.)
Flash point 226.128°C (Cal.)
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