- InChI
- InChI=1S/C17H24O2/c1-2-16(15-11-7-4-8-12-15)17(18)19-13-14-9-5-3-6-10-14/h4,7-8,11-12,14,16H,2-3,5-6,9-10,13H2,1H3
- InChI Key
- QGVVFERCLIIXMH-UHFFFAOYSA-N
- Formula
- C17H24O2
- SMILES
- CCC(C(=O)OCC1CCCCC1)c1ccccc1
- Molecular Weight1
- 260.37
- 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° | -7.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -353.44 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.91 | kJ/mol | Joback Calculated Property |
| log10WS | -4.52 | Crippen Calculated Property | |
| logPoct/wat | 4.304 | Crippen Calculated Property | |
| McVol | 223.210 | ml/mol | McGowan Calculated Property |
| Pc | 1957.87 | kPa | Joback Calculated Property |
| Inp | [1900.00; 1900.00] |
|
|
| Inp | 1900.00 | NIST | |
| Inp | 1900.00 | NIST | |
| Tboil | 710.44 | K | Joback Calculated Property |
| Tc | 936.90 | K | Joback Calculated Property |
| Tfus | 372.31 | K | Joback Calculated Property |
| Vc | 0.831 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [649.77; 751.11] | J/mol×K | [710.44; 936.90] |
|
| Cp,gas | 649.77 | J/mol×K | 710.44 | Joback Calculated Property |
| Cp,gas | 670.21 | J/mol×K | 748.18 | Joback Calculated Property |
| Cp,gas | 689.17 | J/mol×K | 785.93 | Joback Calculated Property |
| Cp,gas | 706.68 | J/mol×K | 823.67 | Joback Calculated Property |
| Cp,gas | 722.81 | J/mol×K | 861.41 | Joback Calculated Property |
| Cp,gas | 737.60 | J/mol×K | 899.15 | Joback Calculated Property |
| Cp,gas | 751.11 | J/mol×K | 936.90 | Joback Calculated Property |
| η | [0.0001052; 0.0024904] | Pa×s | [372.31; 710.44] |
|
| η | 0.0024904 | Pa×s | 372.31 | Joback Calculated Property |
| η | 0.0010393 | Pa×s | 428.66 | Joback Calculated Property |
| η | 0.0005313 | Pa×s | 485.02 | Joback Calculated Property |
| η | 0.0003124 | Pa×s | 541.38 | Joback Calculated Property |
| η | 0.0002030 | Pa×s | 597.73 | Joback Calculated Property |
| η | 0.0001421 | Pa×s | 654.09 | Joback Calculated Property |
| η | 0.0001052 | Pa×s | 710.44 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Butyric acid, 2-phenyl-, cyclohexylmethyl ester.
Sources
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