Chemical Properties of 22-Dihydrobrassicasterol acetate

22-Dihydrobrassicasterol acetate

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InChI
InChI=1S/C30H50O2/c1-19(2)20(3)8-9-21(4)26-12-13-27-25-11-10-23-18-24(32-22(5)31)14-16-29(23,6)28(25)15-17-30(26,27)7/h10,19-21,24-28H,8-9,11-18H2,1-7H3/t20-,21+,24-,25-,26+,27-,28-,29-,30+/m1/s1
InChI Key
JOBAYBRAHVTSSW-NNRQEXCZSA-N
Formula
C30H50O2
SMILES
CC(=O)OC1CCC2(C)C(=CCC3C2CCC2(C)C(C(C)CCC(C)C(C)C)CCC32)C1
Molecular Weight1
442.72
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Physical Properties

Property Value Unit Source
Δf 129.20 kJ/mol Joback Calculated Property
Δfgas -647.00 kJ/mol Joback Calculated Property
Δfus 39.16 kJ/mol Joback Calculated Property
Δvap 88.60 kJ/mol Joback Calculated Property
log10WS -8.61 Crippen Calculated Property
logPoct/wat 8.206 Crippen Calculated Property
McVol 393.260 ml/mol McGowan Calculated Property
Pc 880.00 kPa Joback Calculated Property
Inp 3276.00 NIST
Tboil 999.69 K Joback Calculated Property
Tc 1231.31 K Joback Calculated Property
Tfus 557.54 K Joback Calculated Property
Vc 1.488 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1504.06; 1723.35] J/mol×K [999.69; 1231.31] Show Hide
Cp,gas 1504.06 J/mol×K 999.69 Joback Calculated Property
Cp,gas 1537.82 J/mol×K 1038.29 Joback Calculated Property
Cp,gas 1572.22 J/mol×K 1076.90 Joback Calculated Property
Cp,gas 1607.63 J/mol×K 1115.50 Joback Calculated Property
Cp,gas 1644.38 J/mol×K 1154.10 Joback Calculated Property
Cp,gas 1682.84 J/mol×K 1192.71 Joback Calculated Property
Cp,gas 1723.35 J/mol×K 1231.31 Joback Calculated Property

Similar Compounds

5A-Cholesten-3B-ol, acetate. Cholest-5-en-3-ol (3«beta»)-, acetate. 20-Isocholesterol acetate. Ergost-5-en-3-ol, acetate, (3«beta»,24R)-. Poriferasterol acetate. «beta»-Sitosterol acetate. Clionasterol acetate. 5,23-Stigmastadienol acetate. 28-Isofucosterol acetate. Fucosterol acetate. Cholest-5-en-3-ol (3«beta»)-, propanoate. 5,24-Stigmastadienol acetate. Ergosta-5,24-dien-3-ol, acetate, (3«beta»)-. Cholesta-5,24-dien-3-ol, acetate, (3«beta»)-. 5,23-Ergostadienol acetate.

Find more compounds similar to 22-Dihydrobrassicasterol acetate.

Sources

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