Chemical Properties of 3-Hydroxyestra-1,3,5(10)-triene-16,17-dione (CAS 1228-73-5)

3-Hydroxyestra-1,3,5(10)-triene-16,17-dione

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InChI
InChI=1S/C18H20O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-15,19H,2,4,6-7,9H2,1H3
InChI Key
ANPHVANSJXDRTP-UHFFFAOYSA-N
Formula
C18H20O3
SMILES
CC12CCC3c4ccc(O)cc4CCC3C1CC(=O)C2=O
Molecular Weight1
284.35
CAS
1228-73-5
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Physical Properties

Property Value Unit Source
Δf -51.49 kJ/mol Joback Calculated Property
Δfgas -441.52 kJ/mol Joback Calculated Property
Δfus 25.81 kJ/mol Joback Calculated Property
Δvap 78.73 kJ/mol Joback Calculated Property
log10WS -3.46 Crippen Calculated Property
logPoct/wat 2.996 Crippen Calculated Property
McVol 217.150 ml/mol McGowan Calculated Property
Pc 2605.74 kPa Joback Calculated Property
Tboil 883.49 K Joback Calculated Property
Tc 1156.06 K Joback Calculated Property
Tfus 646.16 K Joback Calculated Property
Vc 0.767 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [748.34; 884.45] J/mol×K [883.49; 1156.06] Show Hide
Cp,gas 748.34 J/mol×K 883.49 Joback Calculated Property
Cp,gas 769.96 J/mol×K 928.92 Joback Calculated Property
Cp,gas 791.54 J/mol×K 974.35 Joback Calculated Property
Cp,gas 813.43 J/mol×K 1019.77 Joback Calculated Property
Cp,gas 835.98 J/mol×K 1065.20 Joback Calculated Property
Cp,gas 859.54 J/mol×K 1110.63 Joback Calculated Property
Cp,gas 884.45 J/mol×K 1156.06 Joback Calculated Property

Similar Compounds

Estrone. Estra-1,3,5(10)-trien-17-one, 3-methoxy-. Gona-1,3,5(10)-trien-17-one, 3-methoxy-, (13«alpha»)-. Gona-1,3,5(10)-trien-17-one, 3-methoxy-. 3-Methoxy-17beta-formyl-1,3,5(10)-estratriene. Estrone, formate. Estra-1,3,5(10)-trien-17-one, 3-hydroxy-2-methoxy-. D-Homoestra-1,3,5(10)-trien-17a-one,3-methoxy-,(8«alpha»)-. Estra-1,3,5(10)-trien-17-one, 3-(acetyloxy)-. Estra-1,3,5(10)-trien-3-ol. Estrone, TFA. Estrone, trifluoroacetate. Trimethylsilylestrone. 3-Hydroxy-16,17-secoestra-1,3,5(10)-triene=16,17-dioic acid. 3-(Pronanoyloxy)-estra-1,3,5(10)-trien-17-one.

Find more compounds similar to 3-Hydroxyestra-1,3,5(10)-triene-16,17-dione.

Sources

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