- InChI
- InChI=1S/C8H11NO/c1-6-4-3-5-7(10-2)8(6)9/h3-5H,9H2,1-2H3
- InChI Key
- HKOJYPPTIPJZAZ-UHFFFAOYSA-N
- Formula
- C8H11NO
- SMILES
- COc1cccc(C)c1N
- Molecular Weight1
- 137.18
- CAS
- 50868-73-0
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 71.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -93.29 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.05 | kJ/mol | Joback Calculated Property |
| log10WS | -1.70 | Crippen Calculated Property | |
| logPoct/wat | 1.586 | Crippen Calculated Property | |
| McVol | 115.670 | ml/mol | McGowan Calculated Property |
| Pc | 3695.46 | kPa | Joback Calculated Property |
| I | [1969.00; 1969.00] |
|
|
| I | 1969.00 | NIST | |
| I | 1969.00 | NIST | |
| Tboil | 514.03 | K | Joback Calculated Property |
| Tc | 737.17 | K | Joback Calculated Property |
| Tfus | 336.87 | K | Joback Calculated Property |
| Vc | 0.422 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [251.04; 313.99] | J/mol×K | [514.03; 737.17] |
|
| Cp,gas | 251.04 | J/mol×K | 514.03 | Joback Calculated Property |
| Cp,gas | 263.00 | J/mol×K | 551.22 | Joback Calculated Property |
| Cp,gas | 274.37 | J/mol×K | 588.41 | Joback Calculated Property |
| Cp,gas | 285.14 | J/mol×K | 625.60 | Joback Calculated Property |
| Cp,gas | 295.33 | J/mol×K | 662.79 | Joback Calculated Property |
| Cp,gas | 304.95 | J/mol×K | 699.98 | Joback Calculated Property |
| Cp,gas | 313.99 | J/mol×K | 737.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methoxy-6-methylaniline.
Sources
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