- InChI
- InChI=1S/C18H23FO2/c1-17-8-7-15-13(14(17)4-5-16(17)21)3-2-11-10-12(20)6-9-18(11,15)19/h6,9-10,13-16,21H,2-5,7-8H2,1H3
- InChI Key
- KMESAHJOIFFQAU-UHFFFAOYSA-N
- Formula
- C18H23FO2
- SMILES
-
CC12CCC3C(CCC4=CC(=O)C=CC43F)C
1CCC2O - Molecular Weight1
- 290.37
- CAS
- 1427-61-8
- 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).
- 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° | -147.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -546.60 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.61 | kJ/mol | Joback Calculated Property |
| log10WS | -4.30 | Crippen Calculated Property | |
| logPoct/wat | 3.357 | Crippen Calculated Property | |
| McVol | 221.650 | ml/mol | McGowan Calculated Property |
| Pc | 2187.68 | kPa | Joback Calculated Property |
| Tboil | 813.26 | K | Joback Calculated Property |
| Tc | 1046.23 | K | Joback Calculated Property |
| Tfus | 529.77 | K | Joback Calculated Property |
| Vc | 0.842 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [758.38; 891.47] | J/mol×K | [813.26; 1046.23] | 
|
| Cp,gas | 758.38 | J/mol×K | 813.26 | Joback Calculated Property |
| Cp,gas | 779.75 | J/mol×K | 852.09 | Joback Calculated Property |
| Cp,gas | 801.04 | J/mol×K | 890.92 | Joback Calculated Property |
| Cp,gas | 822.55 | J/mol×K | 929.74 | Joback Calculated Property |
| Cp,gas | 844.59 | J/mol×K | 968.57 | Joback Calculated Property |
| Cp,gas | 867.46 | J/mol×K | 1007.40 | Joback Calculated Property |
| Cp,gas | 891.47 | J/mol×K | 1046.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 10Beta-fluoro-17beta-hydroxy-estra-1,4-dien-3-one.
Sources
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