Chemical Properties of Estra-1,3,5(10)-triene-3,17-diol, 17-methyl-, (17«beta»)- (CAS 302-76-1)

Estra-1,3,5(10)-triene-3,17-diol, 17-methyl-, (17«beta»)-

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InChI
InChI=1S/C19H26O2/c1-18-9-7-15-14-6-4-13(20)11-12(14)3-5-16(15)17(18)8-10-19(18,2)21/h4,6,11,15-17,20-21H,3,5,7-10H2,1-2H3/t15?,16?,17?,18?,19-/m1/s1
InChI Key
JXQJDYXWHSVOEF-PHDXLQKJSA-N
Formula
C19H26O2
SMILES
CC1(O)CCC2C3CCc4cc(O)ccc4C3CCC21C
Molecular Weight1
286.41
CAS
302-76-1
Other Names
  • Estra-1,3,5(10)-triene-3,17«beta»-diol, 17-methyl-
  • Methylestradiol
  • 17«alpha»-Methylestradiol
  • 17-Methylestradiol
  • 17-«alpha»-methyloestradiol-17-beta
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Physical Properties

Property Value Unit Source
Δf 52.09 kJ/mol Joback Calculated Property
Δfgas -344.09 kJ/mol Joback Calculated Property
Δfus 28.24 kJ/mol Joback Calculated Property
Δvap 87.68 kJ/mol Joback Calculated Property
log10WS -4.69 Crippen Calculated Property
logPoct/wat 3.999 Crippen Calculated Property
McVol 233.970 ml/mol McGowan Calculated Property
Pc 2448.32 kPa Joback Calculated Property
Tboil 858.48 K Joback Calculated Property
Tc 1096.31 K Joback Calculated Property
Tfus 601.47 K Joback Calculated Property
Vc 0.826 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [804.91; 960.77] J/mol×K [858.48; 1096.31] Show Hide
Cp,gas 804.91 J/mol×K 858.48 Joback Calculated Property
Cp,gas 827.29 J/mol×K 898.12 Joback Calculated Property
Cp,gas 850.54 J/mol×K 937.76 Joback Calculated Property
Cp,gas 875.09 J/mol×K 977.40 Joback Calculated Property
Cp,gas 901.36 J/mol×K 1017.04 Joback Calculated Property
Cp,gas 929.78 J/mol×K 1056.67 Joback Calculated Property
Cp,gas 960.77 J/mol×K 1096.31 Joback Calculated Property

Similar Compounds

Estradiol. «alpha»-Estradiol. Ethinyl Estradiol. Estriol. Epiestriol. 17Alpha-ethyl-3-methoxyestra-1,3,5(10)-trien-17beta-ol. Estra-1,3,5(10)-trien-3-ol, 16,17-epoxy-, (16«beta»,17«beta»)-. Estra-1,3,5(10)-triene-3,15,17-triol, (15«alpha»,17«beta»)-. 1,3,5(10)-Oestratrien-17«alpha»-ol, 3-methoxy. Estra-1,3,5(10)-trien-17-ol, 3-methoxy-, (17«beta»)-. Estradiol Valerate. Estradiol Cypionate. 17«alpha»-ethynylestradiol, 3-acetate. Mestranol. 3,17Beta-dihydroxy-1,3,5(10)estratrien-16beta-ylacetic acid lactone.

Find more compounds similar to Estra-1,3,5(10)-triene-3,17-diol, 17-methyl-, (17«beta»)-.

Sources

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