- InChI
- InChI=1S/C7H9NO/c1-9-7-5-3-2-4-6(7)8/h2-5H,8H2,1H3
- InChI Key
- VMPITZXILSNTON-UHFFFAOYSA-N
- Formula
- C7H9NO
- SMILES
- COc1ccccc1N
- Molecular Weight1
- 123.15
- CAS
- 90-04-0
- Other Names
-
- o-Anisidine
- o-Aminoanisole
- o-Methoxyaniline
- 1-Amino-2-methoxybenzene
- 2-Aminoanisole
- 2-Methoxy-1-aminobenzene
- 2-Methoxyaniline
- 2-Methoxybenzenamine
- 2-Anisidine
- o-Methoxyphenylamine
- o-Anisylamine
- 2-Methoxy-phenylamine
- o-Aminophenol methyl ether
- Ortho-anisidine
- 2-Aminomethoxybenzene
- NSC 3122
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°solid : Solid phase 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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 |
|---|---|---|---|
| PAff | 905.20 | kJ/mol | NIST |
| BasG | 873.30 | kJ/mol | NIST |
| ΔcH°solid | -3994.80 ± 1.30 | kJ/mol | NIST |
| ΔfG° | 72.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -61.18 | kJ/mol | Joback Calculated Property |
| ΔfH°solid | -46.00 | kJ/mol | NIST |
| ΔfusH° | 13.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.17 | kJ/mol | Joback Calculated Property |
| IE | 7.50 ± 0.10 | eV | NIST |
| log10WS | -1.23 | Crippen Calculated Property | |
| logPoct/wat | 1.277 | Crippen Calculated Property | |
| McVol | 101.580 | ml/mol | McGowan Calculated Property |
| Pc | 4249.61 | kPa | Joback Calculated Property |
| Inp | [1136.00; 1181.00] |
|
|
| Inp | 1181.00 | NIST | |
| Inp | 1142.70 | NIST | |
| Inp | 1136.00 | NIST | |
| Tboil | [497.20; 498.15] | K |
|
| Tboil | 497.20 | K | NIST |
| Tboil | 498.15 ± 1.50 | K | NIST |
| Tc | 711.90 | K | Joback Calculated Property |
| Tfus | 313.08 | K | Joback Calculated Property |
| Vc | 0.366 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [209.54; 267.51] | J/mol×K | [486.17; 711.90] |
|
| Cp,gas | 209.54 | J/mol×K | 486.17 | Joback Calculated Property |
| Cp,gas | 220.65 | J/mol×K | 523.79 | Joback Calculated Property |
| Cp,gas | 231.16 | J/mol×K | 561.41 | Joback Calculated Property |
| Cp,gas | 241.09 | J/mol×K | 599.03 | Joback Calculated Property |
| Cp,gas | 250.46 | J/mol×K | 636.65 | Joback Calculated Property |
| Cp,gas | 259.26 | J/mol×K | 674.27 | Joback Calculated Property |
| Cp,gas | 267.51 | J/mol×K | 711.90 | Joback Calculated Property |
| ΔvapH | 57.50 | kJ/mol | 413.00 | NIST |
Similar Compounds
Find more compounds similar to Benzenamine, 2-methoxy-.
Sources
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