- InChI
- InChI=1S/C9H12O/c1-7-5-4-6-8(2)9(7)10-3/h4-6H,1-3H3
- InChI Key
- GFNZJAUVJCGWLW-UHFFFAOYSA-N
- Formula
- C9H12O
- SMILES
- COc1c(C)cccc1C
- Molecular Weight1
- 136.19
- Other Names
-
- 2,6-Dimethylanisole
- 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 | 0.4211 | Relay (1.0) Calculated Property | |
| ΔfG° | 13.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -134.47 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.85 | kJ/mol | Relay (1.0) Calculated Property |
| IE | [8.10; 8.53] | eV |
|
| IE | 8.10 ± 0.02 | eV | NIST |
| IE | 8.51 | eV | NIST |
| IE | 8.53 | eV | NIST |
| log10WS | -2.26 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.312 | Crippen Calculated Property | |
| McVol | 119.780 | ml/mol | McGowan Calculated Property |
| Pc | 3093.29 | kPa | Joback Calculated Property |
| Inp | [1040.00; 1078.00] |
|
|
| Inp | 1062.00 | NIST | |
| Inp | 1078.00 | NIST | |
| Inp | 1040.00 | NIST | |
| Inp | 1062.00 | NIST | |
| Tboil | 455.70 | K | NIST |
| Tc | 674.31 | K | Relay (1.0) Calculated Property |
| Tfus | 236.86 | K | Relay (1.0) Calculated Property |
| Vc | 0.433 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [239.92; 308.26] | J/mol×K | [464.58; 673.17] |
|
| Cp,gas | 239.92 | J/mol×K | 464.58 | Joback Calculated Property |
| Cp,gas | 252.66 | J/mol×K | 499.34 | Joback Calculated Property |
| Cp,gas | 264.86 | J/mol×K | 534.11 | Joback Calculated Property |
| Cp,gas | 276.52 | J/mol×K | 568.87 | Joback Calculated Property |
| Cp,gas | 287.63 | J/mol×K | 603.64 | Joback Calculated Property |
| Cp,gas | 298.21 | J/mol×K | 638.40 | Joback Calculated Property |
| Cp,gas | 308.26 | J/mol×K | 673.17 | Joback Calculated Property |
| η | [0.0001851; 0.0013208] | Pa×s | [264.88; 464.58] |
|
| η | 0.0013208 | Pa×s | 264.88 | Joback Calculated Property |
| η | 0.0007929 | Pa×s | 298.16 | Joback Calculated Property |
| η | 0.0005274 | Pa×s | 331.45 | Joback Calculated Property |
| η | 0.0003779 | Pa×s | 364.73 | Joback Calculated Property |
| η | 0.0002863 | Pa×s | 398.01 | Joback Calculated Property |
| η | 0.0002264 | Pa×s | 431.30 | Joback Calculated Property |
| η | 0.0001851 | Pa×s | 464.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,6-DIMETHYLANISOLE.
Sources
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