- InChI
- InChI=1S/C9H11NO2/c1-10-8-6-4-3-5-7(8)9(11)12-2/h3-6,10H,1-2H3
- InChI Key
- GVOWHGSUZUUUDR-UHFFFAOYSA-N
- Formula
- C9H11NO2
- SMILES
- CNc1ccccc1C(=O)OC
- Molecular Weight1
- 165.19
- CAS
- 85-91-6
- Other Names
-
- Anthranilic acid, N-methyl-, methyl ester
- Methyl methanthranilate
- Methyl methylanthranilate
- Methyl o-(methylamino)benzoate
- Methyl N-methyl-o-anthranilate
- Methyl N-methylanthranilate
- N-Methylanthranilic acid, methyl ester
- Methyl-2-(N-methylamino)benzoate
- 2-Methylaminobenzoic acid methyl ester
- Dimethyl anthranilate
- Methyl 2-methylaminobenzoate
- Methyl m-methylanthranilate
- Methyl methylaminobenzoate
- N-Methyl methyl anthranilate
- 2-Methylaminomethyl benzoate
- Benzoic acid, o-(methylamino)-, methyl ester
- Me N-methylanthranilate
- Me N-methylanthranylate
- Methyl benzoate, 2-methylamino
- NSC 9406
- 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).
- Inp : Non-polar retention indices.
- 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° | -16.85 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -195.36 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.16 | kJ/mol | Joback Calculated Property |
| log10WS | -1.72 | Crippen Calculated Property | |
| logPoct/wat | 1.515 | Crippen Calculated Property | |
| McVol | 131.330 | ml/mol | McGowan Calculated Property |
| Pc | 3431.89 | kPa | Joback Calculated Property |
| Inp | [1375.00; 1427.00] |
|
|
| Inp | 1427.00 | NIST | |
| Inp | 1376.00 | NIST | |
| Inp | 1402.00 | NIST | |
| Inp | 1375.00 | NIST | |
| Inp | 1385.00 | NIST | |
| Inp | 1385.00 | NIST | |
| Inp | 1407.90 | NIST | |
| Inp | 1404.00 | NIST | |
| Inp | 1415.00 | NIST | |
| Inp | 1412.00 | NIST | |
| Inp | 1412.00 | NIST | |
| Inp | 1404.00 | NIST | |
| Inp | 1408.00 | NIST | |
| Inp | 1407.00 | NIST | |
| Inp | 1385.00 | NIST | |
| Inp | 1385.00 | NIST | |
| Inp | 1388.00 | NIST | |
| Inp | 1410.00 | NIST | |
| Inp | 1406.00 | NIST | |
| Inp | 1389.00 | NIST | |
| I | [2033.00; 2123.00] |
|
|
| I | 2068.00 | NIST | |
| I | 2033.00 | NIST | |
| I | 2072.00 | NIST | |
| I | 2035.00 | NIST | |
| I | 2082.00 | NIST | |
| I | 2082.00 | NIST | |
| I | 2055.00 | NIST | |
| I | 2082.00 | NIST | |
| I | 2118.00 | NIST | |
| I | 2050.00 | NIST | |
| I | 2082.00 | NIST | |
| I | 2123.00 | NIST | |
| I | 2042.00 | NIST | |
| I | 2104.00 | NIST | |
| Tboil | 563.44 | K | Joback Calculated Property |
| Tc | 780.85 | K | Joback Calculated Property |
| Tfus | 354.95 | K | Joback Calculated Property |
| Vc | 0.490 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [301.19; 365.43] | J/mol×K | [563.44; 780.85] |
|
| Cp,gas | 301.19 | J/mol×K | 563.44 | Joback Calculated Property |
| Cp,gas | 313.64 | J/mol×K | 599.68 | Joback Calculated Property |
| Cp,gas | 325.37 | J/mol×K | 635.91 | Joback Calculated Property |
| Cp,gas | 336.41 | J/mol×K | 672.15 | Joback Calculated Property |
| Cp,gas | 346.75 | J/mol×K | 708.38 | Joback Calculated Property |
| Cp,gas | 356.42 | J/mol×K | 744.62 | Joback Calculated Property |
| Cp,gas | 365.43 | J/mol×K | 780.85 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzoic acid, 2-(methylamino)-, methyl ester.
Sources
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