- InChI
- InChI=1S/C9H16O2/c1-7-3-5-9(6-4-7)11-8(2)10/h7,9H,3-6H2,1-2H3
- InChI Key
- VJBFCCCTSQEGMH-UHFFFAOYSA-N
- Formula
- C9H16O2
- SMILES
- CC(=O)OC1CCC(C)CC1
- Molecular Weight1
- 156.22
- 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° | -192.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -439.91 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 44.90 | kJ/mol | Joback Calculated Property |
| log10WS | -2.22 | Crippen Calculated Property | |
| logPoct/wat | 2.128 | Crippen Calculated Property | |
| McVol | 134.250 | ml/mol | McGowan Calculated Property |
| Pc | 2878.12 | kPa | Joback Calculated Property |
| Inp | 1111.00 | NIST | |
| Tboil | 496.49 | K | Joback Calculated Property |
| Tc | 704.73 | K | Joback Calculated Property |
| Tfus | 266.49 | K | Joback Calculated Property |
| Vc | 0.495 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [308.98; 401.32] | J/mol×K | [496.49; 704.73] | 
|
| Cp,gas | 308.98 | J/mol×K | 496.49 | Joback Calculated Property |
| Cp,gas | 326.41 | J/mol×K | 531.20 | Joback Calculated Property |
| Cp,gas | 343.02 | J/mol×K | 565.90 | Joback Calculated Property |
| Cp,gas | 358.81 | J/mol×K | 600.61 | Joback Calculated Property |
| Cp,gas | 373.79 | J/mol×K | 635.31 | Joback Calculated Property |
| Cp,gas | 387.96 | J/mol×K | 670.02 | Joback Calculated Property |
| Cp,gas | 401.32 | J/mol×K | 704.73 | Joback Calculated Property |
| η | [0.0002776; 0.0031798] | Pa×s | [266.49; 496.49] |
|
| η | 0.0031798 | Pa×s | 266.49 | Joback Calculated Property |
| η | 0.0016403 | Pa×s | 304.82 | Joback Calculated Property |
| η | 0.0009810 | Pa×s | 343.16 | Joback Calculated Property |
| η | 0.0006505 | Pa×s | 381.49 | Joback Calculated Property |
| η | 0.0004650 | Pa×s | 419.82 | Joback Calculated Property |
| η | 0.0003516 | Pa×s | 458.16 | Joback Calculated Property |
| η | 0.0002776 | Pa×s | 496.49 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Acetic acid, cis-4-methylcyclohexyl ester.
Sources
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