Chemical Properties of Cholesteryl butyrate (CAS 521-13-1)

Cholesteryl butyrate

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InChI
InChI=1S/C31H52O2/c1-7-9-29(32)33-24-16-18-30(5)23(20-24)12-13-25-27-15-14-26(22(4)11-8-10-21(2)3)31(27,6)19-17-28(25)30/h12,21-22,24-28H,7-11,13-20H2,1-6H3
InChI Key
CKDZWMVGDHGMFR-UHFFFAOYSA-N
Formula
C31H52O2
SMILES
CCCC(=O)OC1CCC2(C)C(=CCC3C2CCC2(C)C(C(C)CCCC(C)C)CCC32)C1
Molecular Weight1
456.74
CAS
521-13-1
Other Names
  • 5-Cholesten-3«beta»-ol butyrate
  • Cholesterol n-butyrate
  • Cholest-5-en-3-ol (3«beta»)-, butanoate
  • 3«beta»-Butanoyloxycholest-5-ene
  • cholest-5-en-3«beta»-ol butyrate
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Physical Properties

Property Value Unit Source
Δf 140.06 kJ/mol Joback Calculated Property
Δfgas -662.36 kJ/mol Joback Calculated Property
Δfus 45.28 kJ/mol Joback Calculated Property
Δvap 91.22 kJ/mol Joback Calculated Property
log10WS -9.27 Crippen Calculated Property
logPoct/wat 8.740 Crippen Calculated Property
McVol 407.350 ml/mol McGowan Calculated Property
Pc 828.11 kPa Joback Calculated Property
Tboil 1023.01 K Joback Calculated Property
Tc 1255.41 K Joback Calculated Property
Tfus 583.81 K Joback Calculated Property
Vc 1.550 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1575.99; 1806.30] J/mol×K [1023.01; 1255.41] Show Hide
Cp,gas 1575.99 J/mol×K 1023.01 Joback Calculated Property
Cp,gas 1611.10 J/mol×K 1061.74 Joback Calculated Property
Cp,gas 1647.03 J/mol×K 1100.48 Joback Calculated Property
Cp,gas 1684.16 J/mol×K 1139.21 Joback Calculated Property
Cp,gas 1722.84 J/mol×K 1177.95 Joback Calculated Property
Cp,gas 1763.43 J/mol×K 1216.68 Joback Calculated Property
Cp,gas 1806.30 J/mol×K 1255.41 Joback Calculated Property

Similar Compounds

Cholest-5-ene, 3-(1-oxobuthoxy)-. Cholesteryl palmitate. Cholesteryl normal-heptylate. Cholest-5-en-3-ol (3«beta»)-, tetradecanoate. Cholesterol margarate. Cholesteryl laurate. Cholest-5-en-3-ol (3«beta»)-, nonanoate. Cholesteryl stearate. Cholesteryl caprate. Cholest-5-en-3-ol (3«beta»)-, 9-octadecenoate, (Z)-. Cholest-5-en-3-ol (3«beta»)-, propanoate. «beta»-Sitosterol acetate. Poriferasterol acetate. Clionasterol acetate. 22-Dihydrobrassicasterol acetate.

Find more compounds similar to Cholesteryl butyrate.

Sources

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