Chemical Properties of 1,3,5(10)-Oestratriene-2-methoxy-3,16«alpha»,17«beta»-triol, 3-non-deriv-16,17-PFP

1,3,5(10)-Oestratriene-2-methoxy-3,16«alpha»,17«beta»-triol, 3-non-deriv-16,17-PFP

InChI
InChI=1S/C25H24F10O6/c1-21-6-5-11-12(4-3-10-7-15(36)16(39-2)8-13(10)11)14(21)9-17(40-19(37)22(26,27)24(30,31)32)18(21)41-20(38)23(28,29)25(33,34)35/h7-8,11-12,14,17-18,36H,3-6,9H2,1-2H3/t11-,12+,14-,17+,18-,21-/m1/s1
InChI Key
XKCPQLZEMXYPPS-CBPXGTFBSA-N
Formula
C25H24F10O6
SMILES
COc1cc2c(cc1O)CCC1C2CCC2(C)C1CC(OC(=O)C(F)(F)C(F)(F)F)C2OC(=O)C(F)(F)C(F)(F)F
Molecular Weight1
610.44
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Physical Properties

Property Value Unit Source
ΔfusH° 54.58 kJ/mol Joback Calculated Property
logPoct/wat 6.086 Crippen Calculated Property
McVol 351.090 ml/mol McGowan Calculated Property
Inp 2544.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1321.07; 1493.17] J/mol×K [1058.43; 1296.63] Show Hide
Cp,gas 1321.07 J/mol×K 1058.43 Joback Calculated Property
Cp,gas 1345.22 J/mol×K 1098.13 Joback Calculated Property
Cp,gas 1370.68 J/mol×K 1137.83 Joback Calculated Property
Cp,gas 1397.82 J/mol×K 1177.53 Joback Calculated Property
Cp,gas 1427.04 J/mol×K 1217.23 Joback Calculated Property
Cp,gas 1458.69 J/mol×K 1256.93 Joback Calculated Property
Cp,gas 1493.17 J/mol×K 1296.63 Joback Calculated Property

Similar Compounds

1,3,5(10)-Oestratriene-2-methoxy-3,16«alpha»,17«beta»-triol, 3-TMS-16,17-PFP. Estriol, tris(pentafluoropropionate). 16-Epiestriol, tris(pentafluoropropionate). 16-epi-Oestriol, TFA. Estriol, TFA. 16-Epiestriol, tris(trifluoroacetate). Estriol, tris(trifluoroacetate). 1,3,5(10)-Oestratriene-2-methoxy-3,17«beta»-diol, 3-TMS-17-HFB. 1,3,5(10)-Oestratriene-3,17«beta»-diol, 3-non-deriv-17-HFB. 3'-dihydrocinnamoylindicine. Norhydrocodone. 3'-cis-cinnamoylindicine. 3'-trans-cinnamoylindicine. 1,3,5(10)-Oestratriene-2-methoxy-3,16«alpha»,17«beta»-triol, 3-TBDMS-16,17-PFP. 1,3,5(10)-Oestratriene-3,17«beta»-diol, 3-TMS-17-HFB.

Find more compounds similar to 1,3,5(10)-Oestratriene-2-methoxy-3,16«alpha»,17«beta»-triol, 3-non-deriv-16,17-PFP.

Sources

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