- InChI
- InChI=1S/C15H26/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,10,12-15H,6-9H2,1-4H3/t12?,13-,14?,15?/m0/s1
- InChI Key
- IHQBZSSZQWCOOB-IBLUKRHDSA-N
- Formula
- C15H26
- SMILES
- CC1=CCC2C(C)CCC(C(C)C)C2C1
- Molecular Weight1
- 206.37
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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° | 150.99 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -231.62 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.45 | kJ/mol | Joback Calculated Property |
| log10WS | -4.54 | Crippen Calculated Property | |
| logPoct/wat | 4.661 | Crippen Calculated Property | |
| McVol | 196.190 | ml/mol | McGowan Calculated Property |
| Pc | 1834.11 | kPa | Joback Calculated Property |
| Inp | [1511.00; 1511.00] |
|
|
| Inp | 1511.00 | NIST | |
| Inp | 1511.00 | NIST | |
| Tboil | 567.52 | K | Joback Calculated Property |
| Tc | 779.81 | K | Joback Calculated Property |
| Tfus | 270.41 | K | Joback Calculated Property |
| Vc | 0.736 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [522.65; 650.67] | J/mol×K | [567.52; 779.81] |
|
| Cp,gas | 522.65 | J/mol×K | 567.52 | Joback Calculated Property |
| Cp,gas | 547.31 | J/mol×K | 602.90 | Joback Calculated Property |
| Cp,gas | 570.58 | J/mol×K | 638.28 | Joback Calculated Property |
| Cp,gas | 592.50 | J/mol×K | 673.67 | Joback Calculated Property |
| Cp,gas | 613.13 | J/mol×K | 709.05 | Joback Calculated Property |
| Cp,gas | 632.50 | J/mol×K | 744.43 | Joback Calculated Property |
| Cp,gas | 650.67 | J/mol×K | 779.81 | Joback Calculated Property |
| η | [0.0003771; 0.0023277] | Pa×s | [270.41; 567.52] |
|
| η | 0.0023277 | Pa×s | 270.41 | Joback Calculated Property |
| η | 0.0013591 | Pa×s | 319.93 | Joback Calculated Property |
| η | 0.0009166 | Pa×s | 369.45 | Joback Calculated Property |
| η | 0.0006786 | Pa×s | 418.96 | Joback Calculated Property |
| η | 0.0005353 | Pa×s | 468.48 | Joback Calculated Property |
| η | 0.0004419 | Pa×s | 518.00 | Joback Calculated Property |
| η | 0.0003771 | Pa×s | 567.52 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Cadinene.
Sources
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