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Benzestrol
[CAS# 85-95-0]

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Identification
Name Benzestrol
Synonyms 4-[1,2-Diethyl-3-(4-Hydroxyphenyl)Butyl]Phenol; Benzestrol; Benzestrol [Ban:Inn]
Molecular Structure CAS#: 85-95-0, Benzestrol
Molecular Formula C20H26O2
Molecular Weight 298.42
CAS Registry Number 85-95-0
SMILES C2=C(C(C(C(C1=CC=C(O)C=C1)C)CC)CC)C=CC(=C2)O
InChI 1S/C20H26O2/c1-4-19(14(3)15-6-10-17(21)11-7-15)20(5-2)16-8-12-18(22)13-9-16/h6-14,19-22H,4-5H2,1-3H3
InChIKey DUTFBSAKKUNBAL-UHFFFAOYSA-N
Properties
Density 1.063g/cm3 (Cal.)
Boiling point 431.369°C at 760 mmHg (Cal.)
Flash point 192.811°C (Cal.)
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