- InChI
- InChI=1S/C9H13NO/c1-10(2)8-6-4-5-7-9(8)11-3/h4-7H,1-3H3
- InChI Key
- XQFJDFIHJKPUEL-UHFFFAOYSA-N
- Formula
- C9H13NO
- SMILES
- COc1ccccc1N(C)C
- Molecular Weight1
- 151.21
- CAS
- 700-75-4
- Other Names
-
- Benzene, 1-methoxy-2-dimethylamino-
- Benzene, 1-dimethylamino-2-methoxy-
- 2-Methoxy-N,N-dimethylaniline
- ω : Acentric Factor.
- 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).
- 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 | 0.4844 | Relay (1.0) Calculated Property | |
| ΔfG° | 133.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -53.42 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 16.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.24 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.59 ± 0.02 | eV | NIST |
| log10WS | -1.73 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.761 | Crippen Calculated Property | |
| McVol | 129.760 | ml/mol | McGowan Calculated Property |
| Pc | 3138.51 | kPa | Joback Calculated Property |
| Inp | [1213.00; 1213.00] |
|
|
| Inp | 1213.00 | NIST | |
| Inp | 1213.00 | NIST | |
| Tboil | 505.61 | K | Relay (1.0) Calculated Property |
| Tc | 699.63 | K | Relay (1.0) Calculated Property |
| Tfus | 276.85 | K | Relay (1.0) Calculated Property |
| Vc | 0.473 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [270.72; 345.28] | J/mol×K | [471.84; 676.27] |
|
| Cp,gas | 270.72 | J/mol×K | 471.84 | Joback Calculated Property |
| Cp,gas | 284.89 | J/mol×K | 505.91 | Joback Calculated Property |
| Cp,gas | 298.34 | J/mol×K | 539.98 | Joback Calculated Property |
| Cp,gas | 311.09 | J/mol×K | 574.05 | Joback Calculated Property |
| Cp,gas | 323.14 | J/mol×K | 608.12 | Joback Calculated Property |
| Cp,gas | 334.54 | J/mol×K | 642.20 | Joback Calculated Property |
| Cp,gas | 345.28 | J/mol×K | 676.27 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzenamine, 2-methoxy-N,N-dimethyl-.
Sources
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