- InChI
- InChI=1S/C12H22O3/c1-2-3-9-14-12(13)15-10-11-7-5-4-6-8-11/h11H,2-10H2,1H3
- InChI Key
- JLIOMAHBSOWBDM-UHFFFAOYSA-N
- Formula
- C12H22O3
- SMILES
- CCCCOC(=O)OCC1CCCCC1
- Molecular Weight1
- 214.30
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.6070 | Relay (1.0) Calculated Property | |
| ΔfG° | -340.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -729.97 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 24.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.84 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.83 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.75 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.520 | Crippen Calculated Property | |
| McVol | 182.390 | ml/mol | McGowan Calculated Property |
| Pc | 2110.00 | kPa | Joback Calculated Property |
| Inp | 1531.00 | NIST | |
| Tboil | 549.88 | K | Relay (1.0) Calculated Property |
| Tc | 711.44 | K | Relay (1.0) Calculated Property |
| Tfus | 217.75 | K | Relay (1.0) Calculated Property |
| Vc | 0.674 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [475.75; 575.37] | J/mol×K | [574.35; 769.69] | 
|
| Cp,gas | 475.75 | J/mol×K | 574.35 | Joback Calculated Property |
| Cp,gas | 494.73 | J/mol×K | 606.91 | Joback Calculated Property |
| Cp,gas | 512.74 | J/mol×K | 639.46 | Joback Calculated Property |
| Cp,gas | 529.81 | J/mol×K | 672.02 | Joback Calculated Property |
| Cp,gas | 545.93 | J/mol×K | 704.58 | Joback Calculated Property |
| Cp,gas | 561.12 | J/mol×K | 737.13 | Joback Calculated Property |
| Cp,gas | 575.37 | J/mol×K | 769.69 | Joback Calculated Property |
| η | [0.0001470; 0.0043057] | Pa×s | [296.94; 574.35] |
|
| η | 0.0043057 | Pa×s | 296.94 | Joback Calculated Property |
| η | 0.0016784 | Pa×s | 343.17 | Joback Calculated Property |
| η | 0.0008183 | Pa×s | 389.41 | Joback Calculated Property |
| η | 0.0004646 | Pa×s | 435.64 | Joback Calculated Property |
| η | 0.0002941 | Pa×s | 481.88 | Joback Calculated Property |
| η | 0.0002017 | Pa×s | 528.11 | Joback Calculated Property |
| η | 0.0001470 | Pa×s | 574.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, butyl cyclohexylmethyl ester.
Sources
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