Chemical Properties of Estrone, butyrate

Estrone, butyrate

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InChI
InChI=1S/C22H28O3/c1-3-4-21(24)25-15-6-8-16-14(13-15)5-7-18-17(16)11-12-22(2)19(18)9-10-20(22)23/h6,8,13,17-19H,3-5,7,9-12H2,1-2H3
InChI Key
MLGJBWKOEOTZIL-UHFFFAOYSA-N
Formula
C22H28O3
SMILES
CCCC(=O)Oc1ccc2c(c1)CCC1C2CCC2(C)C(=O)CCC12
Molecular Weight1
340.46
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Physical Properties

Property Value Unit Source
Δf 15.85 kJ/mol Joback Calculated Property
Δfgas -465.34 kJ/mol Joback Calculated Property
Δfus 33.27 kJ/mol Joback Calculated Property
Δvap 80.19 kJ/mol Joback Calculated Property
log10WS -5.78 Crippen Calculated Property
logPoct/wat 4.817 Crippen Calculated Property
McVol 273.510 ml/mol McGowan Calculated Property
Pc 1605.13 kPa Joback Calculated Property
Inp [2491.00; 2491.00]   Show Hide
Inp 2491.00 NIST
Inp 2491.00 NIST
Tboil 907.84 K Joback Calculated Property
Tc 1149.77 K Joback Calculated Property
Tfus 595.98 K Joback Calculated Property
Vc 1.042 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [943.76; 1072.02] J/mol×K [907.84; 1149.77] Show Hide
Cp,gas 943.76 J/mol×K 907.84 Joback Calculated Property
Cp,gas 965.68 J/mol×K 948.16 Joback Calculated Property
Cp,gas 987.08 J/mol×K 988.48 Joback Calculated Property
Cp,gas 1008.20 J/mol×K 1028.81 Joback Calculated Property
Cp,gas 1029.25 J/mol×K 1069.13 Joback Calculated Property
Cp,gas 1050.45 J/mol×K 1109.45 Joback Calculated Property
Cp,gas 1072.02 J/mol×K 1149.77 Joback Calculated Property

Similar Compounds

Estrone, octanoate. Estrone, hexanoate. 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. Estrone, formate. 17«alpha»-ethynylestradiol, 3-butyrate. Estrone, heptafluorobutyrate. Estra-1,3,5(10)-trien-17-one, 3-methoxy-. Estradiol dipropionate. Estradiol dipropionate. 17«alpha»-ethynylestradiol, 3-propionate.

Find more compounds similar to Estrone, butyrate.

Sources

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