- InChI
- InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h12,18-21,23,28H,6-11,13-17H2,1-5H3/t19?,20-,21-,23?,26?,27?/m1/s1
- InChI Key
- AWBZPJQUWZBRII-BDHCHTMKSA-N
- Formula
- C27H44O
- SMILES
-
CC(C)CCCC(C)C1CC=C2C3=C(CCC21C
)C1(C)CCC(O)CC1CC3 - Molecular Weight1
- 384.64
- CAS
- 19431-20-0
- Other Names
-
- 5«alpha»-Cholesta-8,14-dien-3«beta»-ol
- «delta»8,14-Cholestadienol
- 5«alpha»-Cholesta-8,14-diene-3«beta»-ol
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | 229.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -411.71 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.07 | kJ/mol | Joback Calculated Property |
| log10WS | -8.34 | Crippen Calculated Property | |
| logPoct/wat | 7.453 | Crippen Calculated Property | |
| McVol | 345.120 | ml/mol | McGowan Calculated Property |
| Pc | 1131.38 | kPa | Joback Calculated Property |
| Inp | 3135.00 | NIST | |
| Tboil | 965.84 | K | Joback Calculated Property |
| Tc | 1190.08 | K | Joback Calculated Property |
| Tfus | 561.67 | K | Joback Calculated Property |
| Vc | 1.310 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1281.97; 1481.97] | J/mol×K | [965.84; 1190.08] | 
|
| Cp,gas | 1281.97 | J/mol×K | 965.84 | Joback Calculated Property |
| Cp,gas | 1312.09 | J/mol×K | 1003.21 | Joback Calculated Property |
| Cp,gas | 1343.05 | J/mol×K | 1040.59 | Joback Calculated Property |
| Cp,gas | 1375.18 | J/mol×K | 1077.96 | Joback Calculated Property |
| Cp,gas | 1408.82 | J/mol×K | 1115.33 | Joback Calculated Property |
| Cp,gas | 1444.31 | J/mol×K | 1152.70 | Joback Calculated Property |
| Cp,gas | 1481.97 | J/mol×K | 1190.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cholesta-8,14-dien-3-ol, (3«beta»,5«alpha»)-.
Sources
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