Chemical Properties of Betamethasone-17-valerate

Betamethasone-17-valerate

InChI
InChI=1S/C27H37FO6/c1-5-6-7-23(33)34-27(22(32)15-29)16(2)12-20-19-9-8-17-13-18(30)10-11-24(17,3)26(19,28)21(31)14-25(20,27)4/h10-11,13,16,19-21,29,31H,5-9,12,14-15H2,1-4H3
InChI Key
SNHRLVCMMWUAJD-UHFFFAOYSA-N
Formula
C27H37FO6
SMILES
CCCCC(=O)OC1(C(=O)CO)C(C)CC2C3CCC4=CC(=O)C=CC4(C)C3(F)C(O)CC21C
Molecular Weight1
476.58
Other Names
  • [9-fluoro-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] pentanoate
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Physical Properties

Property Value Unit Source
ΔfusH° 45.61 kJ/mol Joback Calculated Property
log10WS [-4.71; -4.71]   Show Hide
log10WS -4.71 Aq. Solubility Prediction
log10WS -4.71 Estimated Solubility
logPoct/wat 3.637 Crippen Calculated Property
McVol 363.340 ml/mol McGowan Calculated Property
Tfus 456.65 K Aq. Solubility Prediction

Cheméo can also estimate Normal Boiling Point Temperature, 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 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 [1632.28; 2225.99] J/mol×K [1214.79; 1495.66] Show Hide
Cp,gas 1632.28 J/mol×K 1214.79 Joback Calculated Property
Cp,gas 1707.18 J/mol×K 1261.60 Joback Calculated Property
Cp,gas 1790.49 J/mol×K 1308.41 Joback Calculated Property
Cp,gas 1883.13 J/mol×K 1355.23 Joback Calculated Property
Cp,gas 1985.99 J/mol×K 1402.04 Joback Calculated Property
Cp,gas 2099.97 J/mol×K 1448.85 Joback Calculated Property
Cp,gas 2225.99 J/mol×K 1495.66 Joback Calculated Property

Similar Compounds

Betamethasone dipropionate. Triamcinolone Acetonide. Triamcinolone diacetate. Triamcinolone. Dexamethasone. Betamethasone. Prednisolone, 9alpha-fluoro-16alpha-methyl-, acetate. 9Alpha-fluoro-16alpha-methylprednisolone-21-phosphate disodium salt. Nalmefene, bis(trifluoroacetate). azadirachtin. Dexamethasone tetra-TMS. Flumethasone. (1,S,2S,3R,5S)-(+)-Pinanediol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Dihydrocodeine tms derivative. 9H-Purine, 9-[2-deoxy-3-O-(trimethylsilyl)-«beta»-D-erythro-pentofuranosyl]-6-(trimethylsiloxy)-2-[(trimethylsilyl)amino]-, 5'-[bis(trimethylsilyl) phospate].

Find more compounds similar to Betamethasone-17-valerate.

Sources

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