- InChI
- InChI=1S/C10H14O3/c1-7-9(12-3)5-8(11-2)6-10(7)13-4/h5-6H,1-4H3
- InChI Key
- TZPKFPYZCMHDHL-UHFFFAOYSA-N
- Formula
- C10H14O3
- SMILES
- COc1cc(OC)c(C)c(OC)c1
- Molecular Weight1
- 182.22
- CAS
- 14107-97-2
- Other Names
-
- Benzene, 1,3,5-trimethoxy-2-methyl-
- Toluene, 2,4,6-trimethoxy-
- 1,3,5-Trimethoxy-2-methylbenzene
- 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° | -198.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -444.27 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.35 | kJ/mol | Joback Calculated Property |
| log10WS | -2.31 | Crippen Calculated Property | |
| logPoct/wat | 2.021 | Crippen Calculated Property | |
| McVol | 145.610 | ml/mol | McGowan Calculated Property |
| Pc | 2648.83 | kPa | Joback Calculated Property |
| Inp | [1486.00; 1486.90] |
|
|
| Inp | 1486.90 | NIST | |
| Inp | 1486.00 | NIST | |
| Tboil | 537.08 | K | Joback Calculated Property |
| Tc | 740.25 | K | Joback Calculated Property |
| Tfus | 333.13 | K | Joback Calculated Property |
| Vc | 0.541 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [330.15; 402.12] | J/mol×K | [537.08; 740.25] |
|
| Cp,gas | 330.15 | J/mol×K | 537.08 | Joback Calculated Property |
| Cp,gas | 343.37 | J/mol×K | 570.94 | Joback Calculated Property |
| Cp,gas | 356.13 | J/mol×K | 604.80 | Joback Calculated Property |
| Cp,gas | 368.41 | J/mol×K | 638.66 | Joback Calculated Property |
| Cp,gas | 380.18 | J/mol×K | 672.52 | Joback Calculated Property |
| Cp,gas | 391.43 | J/mol×K | 706.39 | Joback Calculated Property |
| Cp,gas | 402.12 | J/mol×K | 740.25 | Joback Calculated Property |
| η | [0.0001237; 0.0006822] | Pa×s | [333.13; 537.08] |
|
| η | 0.0006822 | Pa×s | 333.13 | Joback Calculated Property |
| η | 0.0004499 | Pa×s | 367.12 | Joback Calculated Property |
| η | 0.0003184 | Pa×s | 401.11 | Joback Calculated Property |
| η | 0.0002378 | Pa×s | 435.10 | Joback Calculated Property |
| η | 0.0001853 | Pa×s | 469.10 | Joback Calculated Property |
| η | 0.0001493 | Pa×s | 503.09 | Joback Calculated Property |
| η | 0.0001237 | Pa×s | 537.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4,6-Trimethoxytoluene.
Sources
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