Chemical Properties of Benzoic acid, 2-[[(3-methylphenyl)amino]carbonyl]- (CAS 85-72-3)

Benzoic acid, 2-[[(3-methylphenyl)amino]carbonyl]-

InChI
InChI=1S/C15H13NO3/c1-10-5-4-6-11(9-10)16-14(17)12-7-2-3-8-13(12)15(18)19/h2-9H,1H3,(H,16,17)(H,18,19)
InChI Key
AZPJXONNBLOZFE-UHFFFAOYSA-N
Formula
C15H13NO3
SMILES
Cc1cccc(NC(=O)c2ccccc2C(=O)O)c1
Molecular Weight1
255.27
CAS
85-72-3
Other Names
  • Phthalanilic acid, 3'-methyl-
  • Duraset
  • Duraset 20W
  • N-m-Tolylphthalamic acid
  • N-m-Tolylphthalaminic acid
  • N-m-t
  • N-Metatolyl phthalamic acid
  • Phthalamate
  • Tomaset
  • 3'-Methylphthalanilic acid
  • Kyselina N-m-tolylftalamova
  • 2-(((3-Methylphenyl)amino)carbonyl)benzoic acid
  • NSC 522078
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Physical Properties

Property Value Unit Source
ΔfH°gas -368.20 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 38.75 kJ/mol Joback Calculated Property
IE 8.21 eV Relay (1.0) Calculated Property
log10WS -3.65 Relay (1.0) Calculated Property
logPoct/wat 2.946 Crippen Calculated Property
McVol 193.680 ml/mol McGowan Calculated Property
Tboil 645.05 K Relay (1.0) Calculated Property
Tc 998.97 K Relay (1.0) Calculated Property
Tfus 446.91 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [245.01; 586.75] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-3.92100e+01
Coefficient B1.25102e+00
Coefficient C-8.23020e-04
Coefficient D1.97960e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 245.01 J/mol×K 273.00 Calculated Property
Cp,gas 309.13 J/mol×K 353.78 Calculated Property
Cp,gas 365.25 J/mol×K 434.56 Calculated Property
Cp,gas 414.01 J/mol×K 515.33 Calculated Property
Cp,gas 456.01 J/mol×K 596.11 Calculated Property
Cp,gas 491.90 J/mol×K 676.89 Calculated Property
Cp,gas 522.29 J/mol×K 757.67 Calculated Property
Cp,gas 547.81 J/mol×K 838.44 Calculated Property
Cp,gas 569.09 J/mol×K 919.22 Calculated Property
Cp,gas 586.75 J/mol×K 1000.00 Calculated Property

Similar Compounds

Benzamide, n-(3-methylphenyl)-2-methyl-. Benzoic acid, 2-[(1-naphthalenylamino)carbonyl]-. Isophthalic acid, monoamide, N-(3-methylphenyl)-, ethyl ester. Isophthalic acid, monoamide, N-(3-methylphenyl)-, isobutyl ester. 3-Fluoro-6-trifluoromethylbenzamide, N-(3-methylphenyl)-. Benzamide, N-(3-methylphenyl)-3-methyl-. 4-Fluoro-2-trifluoromethylbenzamide, N-(3-methylphenyl)-. 3'-Trifluoromethyl-o-toluanilide. Benzamide, N-(3-methylphenyl)-3-trifluoromethyl-. Benzoic acid, 2-[[[4-[(acetylamino)sulfonyl]phenyl]amino]carbonyl]-. 3-Fluoro-5-trifluoromethylbenzamide, N-(3-methylphenyl)-. Benzamide, n-(3-methylphenyl)-3-fluoro-. Benzamide, N-(3-chlorophenyl)-2-methyl-. Isophthalic acid, monoamide, N-(3-methylphenyl)-, heptyl ester. Benzamide, N-(3-methylphenyl)-.

Find more compounds similar to Benzoic acid, 2-[[(3-methylphenyl)amino]carbonyl]-.

Sources

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