- InChI
- InChI=1S/C9H18O/c1-8(2)6-5-7-9(3,4)10/h10H,1,5-7H2,2-4H3
- InChI Key
- ICHVSYBMEODCOO-UHFFFAOYSA-N
- Formula
- C9H18O
- SMILES
- C=C(C)CCCC(C)(C)O
- Molecular Weight1
- 142.24
- CAS
- 32779-58-1
- 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° | -29.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -274.43 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.42 | kJ/mol | Joback Calculated Property |
| log10WS | -2.82 | Crippen Calculated Property | |
| logPoct/wat | 2.504 | Crippen Calculated Property | |
| McVol | 139.240 | ml/mol | McGowan Calculated Property |
| Pc | 2701.41 | kPa | Joback Calculated Property |
| Inp | 995.70 | NIST | |
| Tboil | 490.83 | K | Joback Calculated Property |
| Tc | 664.56 | K | Joback Calculated Property |
| Tfus | 238.71 | K | Joback Calculated Property |
| Vc | 0.529 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [319.24; 388.06] | J/mol×K | [490.83; 664.56] | 
|
| Cp,gas | 319.24 | J/mol×K | 490.83 | Joback Calculated Property |
| Cp,gas | 332.23 | J/mol×K | 519.79 | Joback Calculated Property |
| Cp,gas | 344.58 | J/mol×K | 548.74 | Joback Calculated Property |
| Cp,gas | 356.31 | J/mol×K | 577.70 | Joback Calculated Property |
| Cp,gas | 367.44 | J/mol×K | 606.65 | Joback Calculated Property |
| Cp,gas | 378.02 | J/mol×K | 635.61 | Joback Calculated Property |
| Cp,gas | 388.06 | J/mol×K | 664.56 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 6-Hepten-2-ol, 2,6-dimethyl-.
Sources
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