- InChI
- InChI=1S/C32H52O2/c1-19(2)21(4)32(8)18-29(32)20(3)26-11-12-27-25-10-9-23-17-24(34-22(5)33)13-15-30(23,6)28(25)14-16-31(26,27)7/h10,19-21,23-24,26-29H,9,11-18H2,1-8H3/t20-,21?,23?,24-,26+,27-,28-,29?,30-,31+,32?/m1/s1
- InChI Key
- DMAVMYPLZOJVPK-XDSQRMCBSA-N
- Formula
- C32H52O2
- SMILES
-
CC(=O)OC1CCC2(C)C(CC=C3C2CCC2(
C)C3CCC2C(C)C2CC2(C)C(C)C(C)C) C1 - Molecular Weight1
- 468.75
- 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° | 193.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -620.58 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.25 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.51 | kJ/mol | Joback Calculated Property |
| log10WS | -8.86 | Crippen Calculated Property | |
| logPoct/wat | 8.451 | Crippen Calculated Property | |
| McVol | 410.580 | ml/mol | McGowan Calculated Property |
| Pc | 854.46 | kPa | Joback Calculated Property |
| Inp | 3519.00 | NIST | |
| Tboil | 1047.76 | K | Joback Calculated Property |
| Tc | 1289.93 | K | Joback Calculated Property |
| Tfus | 617.68 | K | Joback Calculated Property |
| Vc | 1.554 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1652.23; 1977.43] | J/mol×K | [1047.76; 1289.93] | 
|
| Cp,gas | 1652.23 | J/mol×K | 1047.76 | Joback Calculated Property |
| Cp,gas | 1697.68 | J/mol×K | 1088.12 | Joback Calculated Property |
| Cp,gas | 1745.89 | J/mol×K | 1128.48 | Joback Calculated Property |
| Cp,gas | 1797.41 | J/mol×K | 1168.84 | Joback Calculated Property |
| Cp,gas | 1852.81 | J/mol×K | 1209.20 | Joback Calculated Property |
| Cp,gas | 1912.63 | J/mol×K | 1249.57 | Joback Calculated Property |
| Cp,gas | 1977.43 | J/mol×K | 1289.93 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Acanthasterol acetate.
Sources
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