Chemical Properties of Testosterone, 3-HFB, 17«beta»-PFB

Testosterone, 3-HFB, 17«beta»-PFB

InChI
InChI=1S/C30H26F12O4/c1-26-9-7-13(45-25(44)28(36,37)29(38,39)30(40,41)42)11-12(26)3-4-14-15-5-6-17(27(15,2)10-8-16(14)26)46-24(43)18-19(31)21(33)23(35)22(34)20(18)32/h7,11,14-17H,3-6,8-10H2,1-2H3/t14?,15?,16?,17-,26-,27-/m1/s1
InChI Key
VQRFVWKMQHJHEY-RIUZPASXSA-N
Formula
C30H26F12O4
SMILES
CC12CC=C(OC(=O)C(F)(F)C(F)(F)C(F)(F)F)C=C1CCC1C2CCC2(C)C(OC(=O)c3c(F)c(F)c(F)c(F)c3F)CCC12
Molecular Weight1
678.51
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Physical Properties

Property Value Unit Source
ΔfusH° 59.10 kJ/mol Joback Calculated Property
log10WS -10.47 Relay (1.0) Calculated Property
logPoct/wat 8.740 Crippen Calculated Property
McVol 393.880 ml/mol McGowan Calculated Property
Inp [3020.00; 3020.00]   Show Hide
Inp 3020.00 NIST
Inp 3020.00 NIST
Tfus 392.48 K Relay (1.0) Calculated Property

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 [1515.04; 1790.21] J/mol×K [1119.24; 1377.75] Show Hide
Cp,gas 1515.04 J/mol×K 1119.24 Joback Calculated Property
Cp,gas 1551.62 J/mol×K 1162.32 Joback Calculated Property
Cp,gas 1591.18 J/mol×K 1205.41 Joback Calculated Property
Cp,gas 1634.27 J/mol×K 1248.49 Joback Calculated Property
Cp,gas 1681.44 J/mol×K 1291.58 Joback Calculated Property
Cp,gas 1733.24 J/mol×K 1334.66 Joback Calculated Property
Cp,gas 1790.21 J/mol×K 1377.75 Joback Calculated Property

Similar Compounds

(1'S,3R,4a'S,5a'S,10a'S)-Methyl 1'-methyl-2-oxo-1',4a',5',5a',7',8',10',10a'-octahydrospiro[indoline-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate. Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (19«alpha»)-. AJMALINE, M(NOR-), AC. Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, acetate (ester), (5«alpha»,6«alpha»)-. Benzylmorphine. ERGOCRYPTINE. Galantamin. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Nicocodine. Indane-cis-1,2-diol, 2-(N,N-dimethylaminomethyl)-ferroceneboronate. N6-(cyclotetramethylene-tertbutylsilyl)-Adenosine, 2',3',5'-tris-O-TBDMS. Norcodeine. 3-propionyl-morphine. Deserpidine. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester).

Find more compounds similar to Testosterone, 3-HFB, 17«beta»-PFB.

Sources

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