- InChI
- InChI=1S/C12H18O/c1-5-13-12-8-11(9(2)3)7-6-10(12)4/h6-9H,5H2,1-4H3
- InChI Key
- DOTAGKFIHPPPTK-UHFFFAOYSA-N
- Formula
- C12H18O
- SMILES
- CCOc1cc(C(C)C)ccc1C
- Molecular Weight1
- 178.27
- 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° | 35.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -214.92 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.93 | kJ/mol | Joback Calculated Property |
| log10WS | -3.67 | Crippen Calculated Property | |
| logPoct/wat | 3.517 | Crippen Calculated Property | |
| McVol | 162.050 | ml/mol | McGowan Calculated Property |
| Pc | 2315.84 | kPa | Joback Calculated Property |
| Inp | [1294.00; 1296.00] |
|
|
| Inp | 1294.00 | NIST | |
| Inp | 1296.00 | NIST | |
| Tboil | 532.58 | K | Joback Calculated Property |
| Tc | 736.76 | K | Joback Calculated Property |
| Tfus | 283.69 | K | Joback Calculated Property |
| Vc | 0.612 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [372.99; 458.96] | J/mol×K | [532.58; 736.76] |
|
| Cp,gas | 372.99 | J/mol×K | 532.58 | Joback Calculated Property |
| Cp,gas | 389.19 | J/mol×K | 566.61 | Joback Calculated Property |
| Cp,gas | 404.62 | J/mol×K | 600.64 | Joback Calculated Property |
| Cp,gas | 419.30 | J/mol×K | 634.67 | Joback Calculated Property |
| Cp,gas | 433.25 | J/mol×K | 668.70 | Joback Calculated Property |
| Cp,gas | 446.46 | J/mol×K | 702.73 | Joback Calculated Property |
| Cp,gas | 458.96 | J/mol×K | 736.76 | Joback Calculated Property |
| η | [0.0001526; 0.0019011] | Pa×s | [283.69; 532.58] |
|
| η | 0.0019011 | Pa×s | 283.69 | Joback Calculated Property |
| η | 0.0009549 | Pa×s | 325.17 | Joback Calculated Property |
| η | 0.0005605 | Pa×s | 366.65 | Joback Calculated Property |
| η | 0.0003667 | Pa×s | 408.13 | Joback Calculated Property |
| η | 0.0002594 | Pa×s | 449.62 | Joback Calculated Property |
| η | 0.0001945 | Pa×s | 491.10 | Joback Calculated Property |
| η | 0.0001526 | Pa×s | 532.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carvacrol, ethyl ether.
Sources
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