Chemical Properties of 5-«alpha»-Pregnan-3-«alpha»,20-«alpha»-diol, HFB

5-«alpha»-Pregnan-3-«alpha»,20-«alpha»-diol, HFB

PDF Excel Molecule Calculator
InChI
InChI=1S/C29H34F14O4/c1-13(46-20(44)24(30,31)26(34,35)28(38,39)40)17-6-7-18-16-5-4-14-12-15(8-10-22(14,2)19(16)9-11-23(17,18)3)47-21(45)25(32,33)27(36,37)29(41,42)43/h13-19H,4-12H2,1-3H3/t13-,14+,15-,16?,17-,18?,19?,22+,23-/m0/s1
InChI Key
KPANXDBYARJMLI-GBOBYPTESA-N
Formula
C29H34F14O4
SMILES
CC(OC(=O)C(F)(F)C(F)(F)C(F)(F)F)C1CCC2C3CCC4CC(OC(=O)C(F)(F)C(F)(F)C(F)(F)F)CCC4(C)C3CCC12C
Molecular Weight1
712.56
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δf -2846.60 kJ/mol Joback Calculated Property
Δfgas -3725.29 kJ/mol Joback Calculated Property
Δfus 45.28 kJ/mol Joback Calculated Property
Δvap 75.83 kJ/mol Joback Calculated Property
log10WS -10.38 Crippen Calculated Property
logPoct/wat 9.155 Crippen Calculated Property
McVol 415.690 ml/mol McGowan Calculated Property
Pc 687.09 kPa Joback Calculated Property
Inp [2548.00; 2552.00]   Show Hide
Inp 2548.00 NIST
Inp 2552.00 NIST
Inp 2552.00 NIST
Tboil 1015.57 K Joback Calculated Property
Tc 1247.63 K Joback Calculated Property
Tfus 653.69 K Joback Calculated Property
Vc 1.667 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1620.11; 1839.38] J/mol×K [1015.57; 1247.63] Show Hide
Cp,gas 1620.11 J/mol×K 1015.57 Joback Calculated Property
Cp,gas 1651.06 J/mol×K 1054.25 Joback Calculated Property
Cp,gas 1683.58 J/mol×K 1092.92 Joback Calculated Property
Cp,gas 1718.17 J/mol×K 1131.60 Joback Calculated Property
Cp,gas 1755.33 J/mol×K 1170.28 Joback Calculated Property
Cp,gas 1795.57 J/mol×K 1208.96 Joback Calculated Property
Cp,gas 1839.38 J/mol×K 1247.63 Joback Calculated Property

Similar Compounds

5-«beta»-Pregnan-3-«alpha»,20-«beta»-diol, HFB. 5-«alpha»-Pregnan-3-«beta»,20-«beta»-diol, HFB. 5-«alpha»-Pregnan-3-«alpha»,20-«beta»-diol, HFB. 5-«beta»-Pregnan-3-«beta»,20-«alpha»-diol, HFB. 5-«beta»-Pregnan-3-«beta»,20-«beta»-diol, HFB. 5-«alpha»-Pregnan-3-«beta»,20-«alpha»-diol, HFB. Menthol, heptafluorobutanoate. 5-«beta»-Androstan-3-«beta»,17-«alpha»-diol, HFB. 5-«alpha»-Androstan-3-«alpha»,17-«beta»-diol, HFB. 5-«alpha»-Androstan-3-«alpha»,17-«alpha»-diol, HFB. 5-«alpha»-Androstan-3-«beta»,17-«beta»-diol, HFB. 5-«alpha»-Androstan-3-«beta»,17-«alpha»-diol, HFB. 5-«beta»-Androstan-3-«alpha»,17-«beta»-diol, HFB. 5-«beta»-Androstan-3-«beta»,17-«beta»-diol, HFB. 5-«beta»-Androstan-3-«alpha»,17-«alpha»-diol, HFB.

Find more compounds similar to 5-«alpha»-Pregnan-3-«alpha»,20-«alpha»-diol, HFB.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.