- InChI
- InChI=1S/C15H24/c1-11(2)14-6-5-13(4)15(14)9-7-12(3)8-10-15/h5,7,11,14H,6,8-10H2,1-4H3
- InChI Key
- ZZDYAQRLRNJKBO-UHFFFAOYSA-N
- Formula
- C15H24
- SMILES
- CC1=CCC2(CC1)C(C)=CCC2C(C)C
- Molecular Weight1
- 204.35
- 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.
- I : 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° | 181.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -129.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.32 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.87 | kJ/mol | Joback Calculated Property |
| log10WS | -4.87 | Crippen Calculated Property | |
| logPoct/wat | 4.725 | Crippen Calculated Property | |
| McVol | 191.890 | ml/mol | McGowan Calculated Property |
| Pc | 2060.49 | kPa | Joback Calculated Property |
| Inp | [1444.00; 1444.00] |
|
|
| Inp | 1444.00 | NIST | |
| Inp | 1444.00 | NIST | |
| I | [1622.00; 1622.00] |
|
|
| I | 1622.00 | NIST | |
| I | 1622.00 | NIST | |
| Tboil | 581.24 | K | Joback Calculated Property |
| Tc | 805.31 | K | Joback Calculated Property |
| Tfus | 316.07 | K | Joback Calculated Property |
| Vc | 0.722 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [501.03; 616.73] | J/mol×K | [581.24; 805.31] |
|
| Cp,gas | 501.03 | J/mol×K | 581.24 | Joback Calculated Property |
| Cp,gas | 523.21 | J/mol×K | 618.59 | Joback Calculated Property |
| Cp,gas | 544.03 | J/mol×K | 655.93 | Joback Calculated Property |
| Cp,gas | 563.63 | J/mol×K | 693.28 | Joback Calculated Property |
| Cp,gas | 582.18 | J/mol×K | 730.62 | Joback Calculated Property |
| Cp,gas | 599.82 | J/mol×K | 767.97 | Joback Calculated Property |
| Cp,gas | 616.73 | J/mol×K | 805.31 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Acora-4,9-diene.
Sources
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