- InChI
- InChI=1S/C11H16O2/c1-8(2)10-7-9(12-3)5-6-11(10)13-4/h5-8H,1-4H3
- InChI Key
- UOMQSUCWUDELOW-UHFFFAOYSA-N
- Formula
- C11H16O2
- SMILES
- COc1ccc(OC)c(C(C)C)c1
- Molecular Weight1
- 180.24
- 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.
- I : 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 | 0.5380 | Relay (... Calculated Property | |
| ΔfG° | -77.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -296.33 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 16.36 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.64 | kJ/mol | Relay (... Calculated Property |
| IE | 7.76 | eV | Relay (... Calculated Property |
| log10WS | -3.53 | Relay (... Calculated Property | |
| logPoct/wat | 2.827 | Crippen Calculated Property | |
| McVol | 153.830 | ml/mol | McGowan Calculated Property |
| Pc | 2502.50 | kPa | Joback Calculated Property |
| Inp | [1399.00; 1399.00] |
|
|
| Inp | 1399.00 | NIST | |
| Inp | 1399.00 | NIST | |
| I | [1852.00; 1852.00] |
|
|
| I | 1852.00 | NIST | |
| I | 1852.00 | NIST | |
| Tboil | 517.24 | K | Relay (... Calculated Property |
| Tc | 711.46 | K | Relay (... Calculated Property |
| Tfus | 321.09 | K | Relay (... Calculated Property |
| Vc | 0.560 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [351.77; 432.15] | J/mol×K | [532.12; 737.45] |
|
| Cp,gas | 351.77 | J/mol×K | 532.12 | Joback Calculated Property |
| Cp,gas | 366.81 | J/mol×K | 566.34 | Joback Calculated Property |
| Cp,gas | 381.19 | J/mol×K | 600.56 | Joback Calculated Property |
| Cp,gas | 394.92 | J/mol×K | 634.78 | Joback Calculated Property |
| Cp,gas | 407.99 | J/mol×K | 669.00 | Joback Calculated Property |
| Cp,gas | 420.40 | J/mol×K | 703.22 | Joback Calculated Property |
| Cp,gas | 432.15 | J/mol×K | 737.45 | Joback Calculated Property |
| η | [0.0001352; 0.0014340] | Pa×s | [294.65; 532.12] |
|
| η | 0.0014340 | Pa×s | 294.65 | Joback Calculated Property |
| η | 0.0007663 | Pa×s | 334.23 | Joback Calculated Property |
| η | 0.0004676 | Pa×s | 373.81 | Joback Calculated Property |
| η | 0.0003137 | Pa×s | 413.38 | Joback Calculated Property |
| η | 0.0002256 | Pa×s | 452.96 | Joback Calculated Property |
| η | 0.0001711 | Pa×s | 492.54 | Joback Calculated Property |
| η | 0.0001352 | Pa×s | 532.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,5-Dimetoxycymene.
Sources
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