- InChI
- InChI=1S/C32H54O2/c1-21(2)10-9-11-22(3)24-14-16-30(8)26-13-12-25-28(5,6)27(34-23(4)33)15-17-31(25)20-32(26,31)19-18-29(24,30)7/h21-22,24-27H,9-20H2,1-8H3
- InChI Key
- RRIPWSLJXZPRIU-UHFFFAOYSA-N
- Formula
- C32H54O2
- SMILES
-
CC(=O)OC1CCC23CC24CCC2(C)C(C(C
)CCCC(C)C)CCC2(C)C4CCC3C1(C)C - Molecular Weight1
- 470.77
- CAS
- 4575-74-0
- Other Names
-
- 9,19-Cyclo-9«beta»-lanostan-3«beta»-ol, acetate
- Cycloartanyl acetate
- 3-O-Acetyl-5a-dihydrocycloartenol
- Cycloartanol acetate
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.7124 | Relay (... Calculated Property | |
| ΔfG° | 188.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -641.24 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 31.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 138.78 | kJ/mol | Relay (... Calculated Property |
| IE | 8.56 | eV | Relay (... Calculated Property |
| log10WS | -7.77 | Relay (... Calculated Property | |
| logPoct/wat | 8.820 | Crippen Calculated Property | |
| McVol | 414.880 | ml/mol | McGowan Calculated Property |
| Pc | 859.99 | kPa | Joback Calculated Property |
| Inp | 3356.00 | NIST | |
| Tboil | 697.54 | K | Relay (... Calculated Property |
| Tc | 1003.78 | K | Relay (... Calculated Property |
| Tfus | 433.14 | K | Relay (... Calculated Property |
| Vc | 1.524 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1695.27; 2147.73] | J/mol×K | [1036.00; 1275.07] | 
|
| Cp,gas | 1695.27 | J/mol×K | 1036.00 | Joback Calculated Property |
| Cp,gas | 1754.19 | J/mol×K | 1075.85 | Joback Calculated Property |
| Cp,gas | 1818.64 | J/mol×K | 1115.69 | Joback Calculated Property |
| Cp,gas | 1889.43 | J/mol×K | 1155.54 | Joback Calculated Property |
| Cp,gas | 1967.35 | J/mol×K | 1195.38 | Joback Calculated Property |
| Cp,gas | 2053.18 | J/mol×K | 1235.23 | Joback Calculated Property |
| Cp,gas | 2147.73 | J/mol×K | 1275.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 9,19-Cyclolanostan-3-ol, acetate, (3«beta»)-.
Sources
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