- InChI
- InChI=1S/C20H30O2/c1-19-10-8-14(21)12-13(19)4-5-15-16-6-7-18(22-3)20(16,2)11-9-17(15)19/h12,15-18H,4-11H2,1-3H3
- InChI Key
- UWXJGQPTBMQNOW-UHFFFAOYSA-N
- Formula
- C20H30O2
- SMILES
-
COC1CCC2C3CCC4=CC(=O)CCC4(C)C3
CCC12C - Molecular Weight1
- 302.45
- Other Names
-
- (17«alpha»)-17-Methoxyandrost-4-en-3-one
- 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° | 66.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -429.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.32 | kJ/mol | Joback Calculated Property |
| log10WS | -4.90 | Crippen Calculated Property | |
| logPoct/wat | 4.533 | Crippen Calculated Property | |
| McVol | 252.360 | ml/mol | McGowan Calculated Property |
| Pc | 1693.51 | kPa | Joback Calculated Property |
| Inp | 2636.00 | NIST | |
| Tboil | 790.83 | K | Joback Calculated Property |
| Tc | 1038.60 | K | Joback Calculated Property |
| Tfus | 512.37 | K | Joback Calculated Property |
| Vc | 0.949 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [856.43; 1015.94] | J/mol×K | [790.83; 1038.60] | 
|
| Cp,gas | 856.43 | J/mol×K | 790.83 | Joback Calculated Property |
| Cp,gas | 883.31 | J/mol×K | 832.12 | Joback Calculated Property |
| Cp,gas | 909.62 | J/mol×K | 873.42 | Joback Calculated Property |
| Cp,gas | 935.68 | J/mol×K | 914.71 | Joback Calculated Property |
| Cp,gas | 961.86 | J/mol×K | 956.01 | Joback Calculated Property |
| Cp,gas | 988.50 | J/mol×K | 997.30 | Joback Calculated Property |
| Cp,gas | 1015.94 | J/mol×K | 1038.60 | Joback Calculated Property |
Similar Compounds
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Sources
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