Chemical Properties of Androst-6-ene-17beta-carboxylic acid, 3alpha-acetamido (CAS 5906-01-4)

Androst-6-ene-17beta-carboxylic acid, 3alpha-acetamido

InChI
InChI=1S/C22H33NO3/c1-13(24)23-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(25)26)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,23,24)(H,25,26)
InChI Key
RDQLUVCEWHEPOU-UHFFFAOYSA-N
Formula
C22H33NO3
SMILES
CC(O)=NC1CCC2(C)C(=CCC3C2CCC2(C)C(C(=O)O)CCC32)C1
Molecular Weight1
359.50
CAS
5906-01-4
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Physical Properties

Property Value Unit Source
ω 0.7960 Relay (1.0) Calculated Property
ΔfG° -31.02 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -655.18 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 167.19 kJ/mol Relay (1.0) Calculated Property
IE 8.32 eV Relay (1.0) Calculated Property
log10WS -4.10 Relay (1.0) Calculated Property
logPoct/wat 4.995 Crippen Calculated Property
McVol 292.090 ml/mol McGowan Calculated Property
Pc 1567.23 kPa Joback Calculated Property
Tboil 667.29 K Relay (1.0) Calculated Property
Tc 997.48 K Relay (1.0) Calculated Property
Tfus 479.20 K Relay (1.0) Calculated Property
Vc 1.012 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Triamcinolone Acetonide. 1H-Indole-3-ethanol, 2-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-, [1S-(1«alpha»,2«alpha»,4«alpha»,5«beta»)]-. norbormide. Ceftazidime. 5-Pregnen-3-«beta»-ol, 20-«alpha»-GlcNAc, MeTMS. 5-Pregnen-3-«alpha»,20-«alpha»-diol-20-GlcNAc TMS. Leu-Trp, N-trimethylsilyl-, trimethylsilyl ester. Nalmefene, bis(trifluoroacetate). Poligodial + 3-methoxy-4,5-methylenedioxyamphetamine (R,S) adduct, # 2. Poligodial + 3-methoxy-4,5-methylenedioxyamphetamine (R,S) adduct, # 1. 11-Hydroxy-.DELTA.-9-tetrahydrocannabinol, bis(trimethylsilyl) ether. Veratraman-11-one, 17,23-epoxy-3-hydroxy-, (3«beta»,23«beta»)-. Nicodicodine. Eburnamenine-14-carboxylic acid, 14,15-dihydro-14-hydroxy-, methyl ester, (3«alpha»,14«alpha»,16«alpha»)-. TCN.

Find more compounds similar to Androst-6-ene-17beta-carboxylic acid, 3alpha-acetamido.

Sources

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