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Estra-1,3,5(10)-Triene-3,17alpha-Diol 3-Benzoate
[CAS# 6045-53-0]

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Identification
Name Estra-1,3,5(10)-Triene-3,17alpha-Diol 3-Benzoate
Synonyms 2-Hydroxy-2,2-Di(Phenyl)-1-(4-Phenyl-1-Piperazinyl)Ethanone; Zinc01025084; St041655
Molecular Structure CAS#: 6045-53-0, Estra-1,3,5(10)-Triene-3,17alpha-Diol 3-Benzoate
Molecular Formula C24H24N2O2
Molecular Weight 372.47
CAS Registry Number 6045-53-0
EINECS 227-938-5
SMILES C4=C(C(O)(C(=O)N1CCN(CC1)C2=CC=CC=C2)C3=CC=CC=C3)C=CC=C4
InChI 1S/C24H24N2O2/c27-23(26-18-16-25(17-19-26)22-14-8-3-9-15-22)24(28,20-10-4-1-5-11-20)21-12-6-2-7-13-21/h1-15,28H,16-19H2
InChIKey UHPOIYLJGFKRDA-UHFFFAOYSA-N
Properties
Density 1.217g/cm3 (Cal.)
Boiling point 603.518°C at 760 mmHg (Cal.)
Flash point 318.797°C (Cal.)
Market Analysis Reports
List of Reports Available for Estra-1,3,5(10)-Triene-3,17alpha-Diol 3-Benzoate
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