Chemical Properties of 6Alpha-(p-nitrobenzamido)-3alpha,5-cyclo-5alpha-androstan-17-one (CAS 103064-86-4)

6Alpha-(p-nitrobenzamido)-3alpha,5-cyclo-5alpha-androstan-17-one

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InChI
InChI=1S/C26H32N2O4/c1-24-11-10-20-18(19(24)7-8-22(24)29)13-21(26-14-16(26)9-12-25(20,26)2)27-23(30)15-3-5-17(6-4-15)28(31)32/h3-6,16,18-21H,7-14H2,1-2H3,(H,27,30)/t16-,18?,19?,20?,21+,24?,25?,26+/m0/s1
InChI Key
JDBQTVZYXDVVOM-HFRMBQMUSA-N
Formula
C26H32N2O4
SMILES
CC12CCC3C(CC(NC(=O)c4ccc([N+](=O)[O-])cc4)C45CC4CCC35C)C1CCC2=O
Molecular Weight1
436.54
CAS
103064-86-4
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Physical Properties

Property Value Unit Source
Δf 384.20 kJ/mol Joback Calculated Property
Δfgas -226.10 kJ/mol Joback Calculated Property
Δfus 45.11 kJ/mol Joback Calculated Property
Δvap 105.96 kJ/mol Joback Calculated Property
log10WS -7.18 Crippen Calculated Property
logPoct/wat 4.915 Crippen Calculated Property
McVol 329.680 ml/mol McGowan Calculated Property
Pc 1551.22 kPa Joback Calculated Property
Tboil 1178.59 K Joback Calculated Property
Tc 1460.70 K Joback Calculated Property
Tfus 877.78 K Joback Calculated Property
Vc 1.274 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1443.81; 1954.49] J/mol×K [1178.59; 1460.70] Show Hide
Cp,gas 1443.81 J/mol×K 1178.59 Joback Calculated Property
Cp,gas 1507.29 J/mol×K 1225.61 Joback Calculated Property
Cp,gas 1578.21 J/mol×K 1272.63 Joback Calculated Property
Cp,gas 1657.49 J/mol×K 1319.65 Joback Calculated Property
Cp,gas 1746.02 J/mol×K 1366.66 Joback Calculated Property
Cp,gas 1844.72 J/mol×K 1413.68 Joback Calculated Property
Cp,gas 1954.49 J/mol×K 1460.70 Joback Calculated Property

Similar Compounds

5Alpha-cycloandrostan-17-one, 6beta-p-nitrobenzamido-3alpha-. Norhydrocodone. Oxymorphone. Oxycodone. 9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 2',3'-diacetate, 5'-bis(3,5-dimethylphenyl)phosphate. Morphinan-6-ol, 4,5-epoxy-3-methoxy-17-methyl-, (5«alpha»,6«alpha»)-. Hydromorphone. Acetyldihydrocodeine. Dihydromorphine. Ibogaine. Methyldihydromorphine. xanthosine-5'-monophosphate, TMS. Yohimbine. Quinine, trimethylsilyl ether. 5,6-Dihydrouracil riboside, TMS.

Find more compounds similar to 6Alpha-(p-nitrobenzamido)-3alpha,5-cyclo-5alpha-androstan-17-one.

Sources

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