Chemical Properties of 3Beta-hydroxy-16,17-secoestra-5(10),6,8-trien-17-oic acid

3Beta-hydroxy-16,17-secoestra-5(10),6,8-trien-17-oic acid

InChI
InChI=1S/C18H24O3/c1-3-16-15-6-4-11-10-12(19)5-7-13(11)14(15)8-9-18(16,2)17(20)21/h4,6,12,16,19H,3,5,7-10H2,1-2H3,(H,20,21)
InChI Key
UYDPGFTYMHWMBX-UHFFFAOYSA-N
Formula
C18H24O3
SMILES
CCC1c2ccc3c(c2CCC1(C)C(=O)O)CCC(O)C3
Molecular Weight1
288.39
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Physical Properties

Property Value Unit Source
ΔfusH° 31.87 kJ/mol Joback Calculated Property
logPoct/wat 3.067 Crippen Calculated Property
McVol 232.310 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [781.94; 883.40] J/mol×K [908.68; 1125.44] Show Hide
Cp,gas 781.94 J/mol×K 908.68 Joback Calculated Property
Cp,gas 798.50 J/mol×K 944.81 Joback Calculated Property
Cp,gas 814.98 J/mol×K 980.93 Joback Calculated Property
Cp,gas 831.55 J/mol×K 1017.06 Joback Calculated Property
Cp,gas 848.37 J/mol×K 1053.19 Joback Calculated Property
Cp,gas 865.60 J/mol×K 1089.32 Joback Calculated Property
Cp,gas 883.40 J/mol×K 1125.44 Joback Calculated Property

Similar Compounds

Hypoxanthine-7-ethanol, 2,3-dihydro-3-(diphenylmethyl)-, acetate. 3-O,6-O,N-Triacetylnormorphine. Benzylmorphine. QUINIDINE, M(HO-), AC. BUPRENORPHINE. Nicocodine. Guanosine, N-trimethylsilyl-, 2',3',5'-tris(trimethylsilyl) ether. Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, acetate (ester), (5«alpha»,6«alpha»)-. Normorphine, N-trimethylsilyl-, bis(trimethylsilyl) ether. DIHYDROERGOKRYPTINE. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. DIHYDROERGOTAMINE. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Methysergide.

Find more compounds similar to 3Beta-hydroxy-16,17-secoestra-5(10),6,8-trien-17-oic acid.

Sources

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