Chemical Properties of Gona-1,3,5(10)-trien-17-one, 3-methoxy-, (13«alpha»)- (CAS 4248-04-8)

Gona-1,3,5(10)-trien-17-one, 3-methoxy-, (13«alpha»)-

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InChI
InChI=1S/C18H22O2/c1-20-12-3-5-13-11(10-12)2-4-15-14(13)6-7-17-16(15)8-9-18(17)19/h3,5,10,14-17H,2,4,6-9H2,1H3/t14?,15?,16?,17-/m0/s1
InChI Key
GDDDQTOBTQTTJD-GZUIOVLMSA-N
Formula
C18H22O2
SMILES
COc1ccc2c(c1)CCC1C2CCC2C(=O)CCC21
Molecular Weight1
270.37
CAS
4248-04-8
Other Names
  • 13«alpha»-Gona-1,3,5(10)-trien-17-one, 3-methoxy-
  • 3-Methoxy-13-«alpha»-gona-1,3,5(10)-trien-17-one
  • 3-Methoxygona-1,3,5(10)-trien-17-one, (13«alpha»)-
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Physical Properties

Property Value Unit Source
Δf 116.58 kJ/mol Joback Calculated Property
Δfgas -285.44 kJ/mol Joback Calculated Property
Δfus 27.61 kJ/mol Joback Calculated Property
Δvap 65.69 kJ/mol Joback Calculated Property
log10WS -4.33 Crippen Calculated Property
logPoct/wat 3.730 Crippen Calculated Property
McVol 215.580 ml/mol McGowan Calculated Property
Pc 2029.06 kPa Joback Calculated Property
Tboil 762.21 K Joback Calculated Property
Tc 1008.42 K Joback Calculated Property
Tfus 477.07 K Joback Calculated Property
Vc 0.815 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [688.38; 793.21] J/mol×K [762.21; 1008.42] Show Hide
Cp,gas 688.38 J/mol×K 762.21 Joback Calculated Property
Cp,gas 709.57 J/mol×K 803.24 Joback Calculated Property
Cp,gas 729.15 J/mol×K 844.28 Joback Calculated Property
Cp,gas 747.21 J/mol×K 885.31 Joback Calculated Property
Cp,gas 763.85 J/mol×K 926.35 Joback Calculated Property
Cp,gas 779.15 J/mol×K 967.38 Joback Calculated Property
Cp,gas 793.21 J/mol×K 1008.42 Joback Calculated Property

Similar Compounds

Gona-1,3,5(10)-trien-17-one, 3-methoxy-. Estra-1,3,5(10)-trien-17-one, 3-methoxy-. 3-Methoxy-17beta-formyl-1,3,5(10)-estratriene. Estrone, formate. D-Homoestra-1,3,5(10)-trien-17a-one,3-methoxy-,(8«alpha»)-. Estra-1,3,5(10)-trien-17-one, 3-(acetyloxy)-. Estrone, TFA. Estrone, trifluoroacetate. Estrone. 3-Hydroxyestra-1,3,5(10)-triene-16,17-dione. Estrone, pentafluoropropionate. 3-(Pronanoyloxy)-estra-1,3,5(10)-trien-17-one. Trimethylsilylestrone. Estra-1,3,5(10)-trien-17-one, 3-hydroxy-2-methoxy-. Estrone, benzoate.

Find more compounds similar to Gona-1,3,5(10)-trien-17-one, 3-methoxy-, (13«alpha»)-.

Sources

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