- InChI
- InChI=1S/C21H28O5/c1-20-7-6-13(24)8-12(20)2-3-14-15-4-5-16(18(26)10-22)21(15,11-23)9-17(25)19(14)20/h8,11,14-17,19,22,25H,2-7,9-10H2,1H3
- InChI Key
- PQSUYGKTWSAVDQ-UHFFFAOYSA-N
- Formula
- C21H28O5
- SMILES
-
CC12CCC(=O)C=C1CCC1C2C(O)CC2(C
=O)C(C(=O)CO)CCC12 - Molecular Weight1
- 360.44
- CAS
- 52-39-1
- Other Names
-
- (+)-Aldosterone
- 11«beta»,21-Dihydroxy-3,20-diketopregn-4-ene-18-al
- 11«beta»,21-Dihydroxy-3,20-dioxo-pregn-4-en-18-al
- 11«beta»,21-Dihydroxypregn-4-ene-3,18,20-trione
- 11«beta»,21-Dihydroxy-3,20-diketopregn-4-ene-18-al
- 11«beta»,21-Dihydroxy-3,20-dioxo-pregn-4-en-18-al
- 11«beta»,21-Dihydroxypregn-4-ene-3,18,20-trione
- 18-Formyl-11«beta»,21-dihydroxy-4-pregnene-3,20-dione
- 18-Formyl-11«beta»,21-dihydroxy-4-pregnene-3,20-dione
- 18-Oxocorticosterone
- Aldocorten
- Aldocortene
- Aldocortin
- D-Aldosterone
- Electrocortin
- Elektrocortin
- NSC 73856
- Pregn-4-en-18-al, 11,21-dihydroxy-3,20-dioxo-, (11«beta»)-
- Pregn-4-en-18-al, 11,21-dihydroxy-3,20-dioxo-, (11«beta»)-
- Reichstein X
- 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° | -330.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -840.92 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 111.65 | kJ/mol | Joback Calculated Property |
| log10WS | [-3.85; -3.85] |
|
|
| log10WS | -3.85 | Aq. Sol... | |
| log10WS | -3.85 | Estimat... | |
| logPoct/wat | 1.846 | Crippen Calculated Property | |
| McVol | 275.460 | ml/mol | McGowan Calculated Property |
| Pc | 2027.23 | kPa | Joback Calculated Property |
| Tboil | 1073.51 | K | Joback Calculated Property |
| Tc | 1316.26 | K | Joback Calculated Property |
| Tfus | 710.74 | K | Joback Calculated Property |
| Vc | 1.046 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1096.69; 1304.84] | J/mol×K | [1073.51; 1316.26] |
|
| Cp,gas | 1096.69 | J/mol×K | 1073.51 | Joback Calculated Property |
| Cp,gas | 1125.82 | J/mol×K | 1113.97 | Joback Calculated Property |
| Cp,gas | 1156.71 | J/mol×K | 1154.43 | Joback Calculated Property |
| Cp,gas | 1189.71 | J/mol×K | 1194.89 | Joback Calculated Property |
| Cp,gas | 1225.17 | J/mol×K | 1235.35 | Joback Calculated Property |
| Cp,gas | 1263.43 | J/mol×K | 1275.80 | Joback Calculated Property |
| Cp,gas | 1304.84 | J/mol×K | 1316.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Aldosterone.
Sources
- Crippen Method
- Joback Method
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
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