- InChI
- InChI=1S/C15H22/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7,9,12,14-15H,6,8H2,1-4H3/t12-,14+,15-/m0/s1
- InChI Key
- QNFAKPNPKWLYEY-CFVMTHIKSA-N
- Formula
- C15H22
- SMILES
- CC1=CC2C(=C(C)C)CCC(C)C2C=C1
- Molecular Weight1
- 202.34
- Other Names
-
- (+)-(1S,6S,10S)-Amorpha-2,4,7(11)-triene
- 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° | 228.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -81.98 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.30 | kJ/mol | Joback Calculated Property |
| log10WS | -4.73 | Crippen Calculated Property | |
| logPoct/wat | 4.501 | Crippen Calculated Property | |
| McVol | 187.590 | ml/mol | McGowan Calculated Property |
| Pc | 1992.98 | kPa | Joback Calculated Property |
| Inp | [1449.00; 1449.00] |
|
|
| Inp | 1449.00 | NIST | |
| Inp | 1449.00 | NIST | |
| Inp | 1449.00 | NIST | |
| Tboil | 578.31 | K | Joback Calculated Property |
| Tc | 798.74 | K | Joback Calculated Property |
| Tfus | 286.81 | K | Joback Calculated Property |
| Vc | 0.713 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [483.35; 596.16] | J/mol×K | [578.31; 798.74] |
|
| Cp,gas | 483.35 | J/mol×K | 578.31 | Joback Calculated Property |
| Cp,gas | 505.27 | J/mol×K | 615.05 | Joback Calculated Property |
| Cp,gas | 525.87 | J/mol×K | 651.79 | Joback Calculated Property |
| Cp,gas | 545.20 | J/mol×K | 688.53 | Joback Calculated Property |
| Cp,gas | 563.31 | J/mol×K | 725.27 | Joback Calculated Property |
| Cp,gas | 580.28 | J/mol×K | 762.00 | Joback Calculated Property |
| Cp,gas | 596.16 | J/mol×K | 798.74 | Joback Calculated Property |
Similar Compounds
![1,3-Cyclohexadiene, 5-(1,5-dimethyl-4-hexenyl)-2-methyl-, [S-(R*,S*)]-.](data:image/png;base64,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)
Find more compounds similar to Amorpha-2,4,7(11)-triene.
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