- InChI
- InChI=1S/C10H13NO2/c1-11(2)9(10(12)13)8-6-4-3-5-7-8/h3-7,9H,1-2H3,(H,12,13)
- InChI Key
- MLOBRLOZPSSKKO-UHFFFAOYSA-N
- Formula
- C10H13NO2
- SMILES
- CN(C)C(C(=O)O)c1ccccc1
- Molecular Weight1
- 179.22
- 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° | -11.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -215.76 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.21 | kJ/mol | Joback Calculated Property |
| log10WS | -1.24 | Crippen Calculated Property | |
| logPoct/wat | 1.374 | Crippen Calculated Property | |
| McVol | 145.420 | ml/mol | McGowan Calculated Property |
| Pc | 3517.91 | kPa | Joback Calculated Property |
| I | [2037.00; 2037.00] |
|
|
| I | 2037.00 | NIST | |
| I | 2037.00 | NIST | |
| Tboil | 612.93 | K | Joback Calculated Property |
| Tc | 814.53 | K | Joback Calculated Property |
| Tfus | 357.10 | K | Joback Calculated Property |
| Vc | 0.524 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [364.00; 425.41] | J/mol×K | [612.93; 814.53] |
|
| Cp,gas | 364.00 | J/mol×K | 612.93 | Joback Calculated Property |
| Cp,gas | 376.06 | J/mol×K | 646.53 | Joback Calculated Property |
| Cp,gas | 387.35 | J/mol×K | 680.13 | Joback Calculated Property |
| Cp,gas | 397.88 | J/mol×K | 713.73 | Joback Calculated Property |
| Cp,gas | 407.72 | J/mol×K | 747.33 | Joback Calculated Property |
| Cp,gas | 416.88 | J/mol×K | 780.93 | Joback Calculated Property |
| Cp,gas | 425.41 | J/mol×K | 814.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N,N-dimethylphenylglycine.
Sources
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