- InChI
- InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h9,12,14-15H,5-8H2,1-4H3
- InChI Key
- YBEONGKDMARZSS-UHFFFAOYSA-N
- Formula
- C15H24
- SMILES
- CC1=CC2C(=C(C)C)CCC(C)C2CC1
- 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.
- 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° | 198.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -139.76 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.01 | 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 | 1930.44 | kPa | Joback Calculated Property |
| Inp | [1480.00; 1480.00] |
|
|
| Inp | 1480.00 | NIST | |
| Inp | 1480.00 | NIST | |
| Tboil | 579.15 | K | Joback Calculated Property |
| Tc | 797.50 | K | Joback Calculated Property |
| Tfus | 286.05 | K | Joback Calculated Property |
| Vc | 0.727 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [503.43; 622.30] | J/mol×K | [579.15; 797.50] |
|
| Cp,gas | 503.43 | J/mol×K | 579.15 | Joback Calculated Property |
| Cp,gas | 526.45 | J/mol×K | 615.54 | Joback Calculated Property |
| Cp,gas | 548.11 | J/mol×K | 651.93 | Joback Calculated Property |
| Cp,gas | 568.46 | J/mol×K | 688.33 | Joback Calculated Property |
| Cp,gas | 587.58 | J/mol×K | 724.72 | Joback Calculated Property |
| Cp,gas | 605.50 | J/mol×K | 761.11 | Joback Calculated Property |
| Cp,gas | 622.30 | J/mol×K | 797.50 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to ent-(+)-Amorpha-4,11-diene.
Sources
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