- InChI
- InChI=1S/C23H34O4/c1-14(24)26-17-9-11-22(3)16(13-17)5-6-18-19-7-8-21(27-15(2)25)23(19,4)12-10-20(18)22/h13,17-21H,5-12H2,1-4H3
- InChI Key
- FKDRTPPOFBKQAT-UHFFFAOYSA-N
- Formula
- C23H34O4
- SMILES
-
CC(=O)OC1C=C2CCC3C(CCC4(C)C(OC
(C)=O)CCC34)C2(C)CC1 - Molecular Weight1
- 374.51
- CAS
- 4136-03-2
- 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° | -156.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -731.48 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.34 | kJ/mol | Joback Calculated Property |
| log10WS | -5.62 | Crippen Calculated Property | |
| logPoct/wat | 4.813 | Crippen Calculated Property | |
| McVol | 302.070 | ml/mol | McGowan Calculated Property |
| Pc | 1395.41 | kPa | Joback Calculated Property |
| Tboil | 917.14 | K | Joback Calculated Property |
| Tc | 1152.33 | K | Joback Calculated Property |
| Tfus | 595.81 | K | Joback Calculated Property |
| Vc | 1.139 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1091.99; 1262.85] | J/mol×K | [917.14; 1152.33] | 
|
| Cp,gas | 1091.99 | J/mol×K | 917.14 | Joback Calculated Property |
| Cp,gas | 1118.88 | J/mol×K | 956.34 | Joback Calculated Property |
| Cp,gas | 1145.99 | J/mol×K | 995.54 | Joback Calculated Property |
| Cp,gas | 1173.62 | J/mol×K | 1034.74 | Joback Calculated Property |
| Cp,gas | 1202.10 | J/mol×K | 1073.94 | Joback Calculated Property |
| Cp,gas | 1231.74 | J/mol×K | 1113.14 | Joback Calculated Property |
| Cp,gas | 1262.85 | J/mol×K | 1152.33 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3Beta,17beta-diacetoxyandrost-5-ene.
Sources
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