- InChI
- InChI=1S/C16H28O/c1-12-6-5-8-16(4)9-7-13(10-14(12)16)11-15(2,3)17/h13-14,17H,1,5-11H2,2-4H3
- InChI Key
- GMZKBWZWDAAWPI-UHFFFAOYSA-N
- Formula
- C16H28O
- SMILES
- C=C1CCCC2(C)CCC(CC(C)(C)O)CC12
- Molecular Weight1
- 236.39
- 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° | 62.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -334.45 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.81 | kJ/mol | Joback Calculated Property |
| log10WS | -4.81 | Crippen Calculated Property | |
| logPoct/wat | 4.310 | Crippen Calculated Property | |
| McVol | 216.150 | ml/mol | McGowan Calculated Property |
| Pc | 1971.80 | kPa | Joback Calculated Property |
| Inp | [1631.00; 1632.00] |
|
|
| Inp | 1631.00 | NIST | |
| Inp | 1632.00 | NIST | |
| Tboil | 679.72 | K | Joback Calculated Property |
| Tc | 887.83 | K | Joback Calculated Property |
| Tfus | 388.46 | K | Joback Calculated Property |
| Vc | 0.802 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [652.68; 761.85] | J/mol×K | [679.72; 887.83] |
|
| Cp,gas | 652.68 | J/mol×K | 679.72 | Joback Calculated Property |
| Cp,gas | 673.06 | J/mol×K | 714.41 | Joback Calculated Property |
| Cp,gas | 692.37 | J/mol×K | 749.09 | Joback Calculated Property |
| Cp,gas | 710.76 | J/mol×K | 783.78 | Joback Calculated Property |
| Cp,gas | 728.38 | J/mol×K | 818.46 | Joback Calculated Property |
| Cp,gas | 745.36 | J/mol×K | 853.15 | Joback Calculated Property |
| Cp,gas | 761.85 | J/mol×K | 887.83 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Zingiberol.
Sources
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