- InChI
- InChI=1S/C20H34O2/c1-14(13-18(21)22)7-9-16-15(2)8-10-17-19(3,4)11-6-12-20(16,17)5/h8,14,16-17H,6-7,9-13H2,1-5H3,(H,21,22)
- InChI Key
- FEENGIUGOPKQTF-UHFFFAOYSA-N
- Formula
- C20H34O2
- SMILES
-
CC1=CCC2C(C)(C)CCCC2(C)C1CCC(C
)CC(=O)O - Molecular Weight1
- 306.48
- CAS
- 468-82-6
- Other Names
-
- Labd-7-en-15-oic acid
- Catavic acid
- Cativic acid
- 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° | -83.63 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -569.15 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.70 | kJ/mol | Joback Calculated Property |
| log10WS | -5.73 | Crippen Calculated Property | |
| logPoct/wat | 5.676 | Crippen Calculated Property | |
| McVol | 274.080 | ml/mol | McGowan Calculated Property |
| Pc | 1514.03 | kPa | Joback Calculated Property |
| Inp | [2334.70; 2334.70] |
|
|
| Inp | 2334.70 | NIST | |
| Inp | 2334.70 | NIST | |
| Tboil | 828.45 | K | Joback Calculated Property |
| Tc | 1036.19 | K | Joback Calculated Property |
| Tfus | 485.31 | K | Joback Calculated Property |
| Vc | 1.036 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [911.37; 1043.60] | J/mol×K | [828.45; 1036.19] |
|
| Cp,gas | 911.37 | J/mol×K | 828.45 | Joback Calculated Property |
| Cp,gas | 933.16 | J/mol×K | 863.07 | Joback Calculated Property |
| Cp,gas | 954.78 | J/mol×K | 897.70 | Joback Calculated Property |
| Cp,gas | 976.42 | J/mol×K | 932.32 | Joback Calculated Property |
| Cp,gas | 998.30 | J/mol×K | 966.94 | Joback Calculated Property |
| Cp,gas | 1020.63 | J/mol×K | 1001.57 | Joback Calculated Property |
| Cp,gas | 1043.60 | J/mol×K | 1036.19 | Joback Calculated Property |
Similar Compounds
Sources
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