- InChI
- InChI=1S/C15H24O/c1-9(2)12-6-5-11(4)15-13(12)7-10(3)8-14(15)16/h5,7,9,12-16H,6,8H2,1-4H3/t12-,13+,14-,15-/m0/s1
- InChI Key
- STLBTFMCSOXEAQ-XGUBFFRZSA-N
- Formula
- C15H24O
- SMILES
- CC1=CC2C(C(C)C)CC=C(C)C2C(O)C1
- Molecular Weight1
- 220.35
- 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° | 34.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -337.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.08 | kJ/mol | Joback Calculated Property |
| log10WS | -4.01 | Crippen Calculated Property | |
| logPoct/wat | 3.552 | Crippen Calculated Property | |
| McVol | 197.760 | ml/mol | McGowan Calculated Property |
| Pc | 2025.41 | kPa | Joback Calculated Property |
| Inp | [1713.00; 1713.00] |
|
|
| Inp | 1713.00 | NIST | |
| Inp | 1713.00 | NIST | |
| Tboil | 663.84 | K | Joback Calculated Property |
| Tc | 864.81 | K | Joback Calculated Property |
| Tfus | 344.51 | K | Joback Calculated Property |
| Vc | 0.741 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [578.38; 676.39] | J/mol×K | [663.84; 864.81] |
|
| Cp,gas | 578.38 | J/mol×K | 663.84 | Joback Calculated Property |
| Cp,gas | 597.29 | J/mol×K | 697.34 | Joback Calculated Property |
| Cp,gas | 615.12 | J/mol×K | 730.83 | Joback Calculated Property |
| Cp,gas | 631.91 | J/mol×K | 764.33 | Joback Calculated Property |
| Cp,gas | 647.70 | J/mol×K | 797.82 | Joback Calculated Property |
| Cp,gas | 662.51 | J/mol×K | 831.32 | Joback Calculated Property |
| Cp,gas | 676.39 | J/mol×K | 864.81 | Joback Calculated Property |
| η | [0.0001311; 0.0043769] | Pa×s | [344.51; 663.84] |
|
| η | 0.0043769 | Pa×s | 344.51 | Joback Calculated Property |
| η | 0.0016494 | Pa×s | 397.73 | Joback Calculated Property |
| η | 0.0007826 | Pa×s | 450.95 | Joback Calculated Property |
| η | 0.0004346 | Pa×s | 504.17 | Joback Calculated Property |
| η | 0.0002700 | Pa×s | 557.40 | Joback Calculated Property |
| η | 0.0001823 | Pa×s | 610.62 | Joback Calculated Property |
| η | 0.0001311 | Pa×s | 663.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Amorpha-4,9-dien-2«alpha»-ol.
Sources
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