- InChI
- InChI=1S/C10H16/c1-7-4-5-8-9(6-7)10(8,2)3/h4,8-9H,5-6H2,1-3H3/t8-,9+/m1/s1
- InChI Key
- BQOFWKZOCNGFEC-BDAKNGLRSA-N
- Formula
- C10H16
- SMILES
- CC1=CCC2C(C1)C2(C)C
- Molecular Weight1
- 136.23
- CAS
- 498-15-7
- Other Names
-
- (+)-«delta»3-Carene
- (1S)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
- (1S,6R)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
- (1S,6R)-3-carene
- 3,7,7-Trimethylbicyclo[4.1.0]hept-3-ene-, (1S,6R)-
- Bicyclo[4.1.0]hept-3-ene, 3,7,7-trimethyl-, (1S)-
- Isodiprene
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- IE : Ionization energy (eV).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | 38.52 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 11.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.50 | kJ/mol | NIST |
| IE | 8.51 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.999 | Crippen Calculated Property | |
| McVol | 125.740 | ml/mol | McGowan Calculated Property |
| Inp | [994.21; 1025.31] |
|
|
| Inp | 1012.09 | NIST | |
| Inp | 1015.29 | NIST | |
| Inp | 1018.60 | NIST | |
| Inp | 1021.88 | NIST | |
| Inp | 1025.31 | NIST | |
| Inp | 994.21 | NIST | |
| Inp | 996.99 | NIST | |
| Inp | 1000.00 | NIST | |
| Inp | 1002.83 | NIST | |
| Inp | 1005.88 | NIST | |
| Inp | 1008.96 | NIST | |
| Inp | 995.00 | NIST | |
| Inp | 1002.00 | NIST | |
| Inp | 1010.00 | NIST | |
| Inp | 995.00 | NIST | |
| Inp | 1012.09 | NIST | |
| Inp | 994.21 | NIST | |
| Inp | 1008.96 | NIST | |
| Inp | 1010.00 | NIST | |
| I | [1148.00; 1148.00] |
|
|
| I | 1148.00 | NIST | |
| I | 1148.00 | NIST | |
| Tboil | 442.63 | K | Measurement and correlation of vapor-liquid equilibrium data for binary systems composed of camphene, (+)-3-carene, (-)-beta-caryophyllene, p-cymene, and alpha-pinene at 101.33 kPa |
Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 396.70 | K | 26.70 | NIST |
Similar Compounds
Find more compounds similar to (+)-3-Carene.
Mixtures
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Thermodynamic study of selected monoterpenes III
- Measurement and correlation of vapor-liquid equilibrium data for binary systems composed of camphene, (+)-3-carene, (-)-beta-caryophyllene, p-cymene, and alpha-pinene at 101.33 kPa
- Joback Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
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