Chemical Properties of Estrone, octanoate

Estrone, octanoate

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InChI
InChI=1S/C26H36O3/c1-3-4-5-6-7-8-25(28)29-19-10-12-20-18(17-19)9-11-22-21(20)15-16-26(2)23(22)13-14-24(26)27/h10,12,17,21-23H,3-9,11,13-16H2,1-2H3
InChI Key
QWDKZLPKJDGSQR-UHFFFAOYSA-N
Formula
C26H36O3
SMILES
CCCCCCCC(=O)Oc1ccc2c(c1)CCC1C2CCC2(C)C(=O)CCC12
Molecular Weight1
396.56
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Physical Properties

Property Value Unit Source
Δf 49.53 kJ/mol Joback Calculated Property
Δfgas -547.90 kJ/mol Joback Calculated Property
Δfus 43.63 kJ/mol Joback Calculated Property
Δvap 89.10 kJ/mol Joback Calculated Property
log10WS -7.45 Crippen Calculated Property
logPoct/wat 6.378 Crippen Calculated Property
McVol 329.870 ml/mol McGowan Calculated Property
Pc 1205.63 kPa Joback Calculated Property
Inp [2851.00; 2851.00]   Show Hide
Inp 2851.00 NIST
Inp 2851.00 NIST
Tboil 999.36 K Joback Calculated Property
Tc 1235.59 K Joback Calculated Property
Tfus 641.06 K Joback Calculated Property
Vc 1.266 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1199.10; 1343.63] J/mol×K [999.36; 1235.59] Show Hide
Cp,gas 1199.10 J/mol×K 999.36 Joback Calculated Property
Cp,gas 1223.03 J/mol×K 1038.73 Joback Calculated Property
Cp,gas 1246.72 J/mol×K 1078.10 Joback Calculated Property
Cp,gas 1270.40 J/mol×K 1117.47 Joback Calculated Property
Cp,gas 1294.30 J/mol×K 1156.84 Joback Calculated Property
Cp,gas 1318.64 J/mol×K 1196.22 Joback Calculated Property
Cp,gas 1343.63 J/mol×K 1235.59 Joback Calculated Property

Similar Compounds

Estrone, hexanoate. Estrone, butyrate. Estrone, 4-chlorobutyrate. 3-(Pronanoyloxy)-estra-1,3,5(10)-trien-17-one. Estrone, pentafluoropropionate. Estra-1,3,5(10)-trien-17-one, 3-(acetyloxy)-. Estrone, TFA. Estrone, trifluoroacetate. 17«alpha»-ethynylestradiol, 3-butyrate. Estrone, formate. Estradiol dipropionate. Estradiol dipropionate. 17«alpha»-ethynylestradiol, 3-propionate. Estrone, heptafluorobutyrate. Estrone, benzoate.

Find more compounds similar to Estrone, octanoate.

Sources

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