Chemical Properties of Chloramben methyl

Chloramben methyl

InChI
InChI=1S/C8H7Cl2NO2/c1-13-8(12)5-2-4(9)3-6(11)7(5)10/h2-3H,11H2,1H3
InChI Key
DTSSCQVCVYZGSI-UHFFFAOYSA-N
Formula
C8H7Cl2NO2
SMILES
COC(=O)c1cc(Cl)cc(N)c1Cl
Molecular Weight1
220.06
Other Names
  • 2,5-Dichloro-3-aminobenzoic acid, methyl ester
  • 3-Amino-2,5-dichlorobenzoic acid, methyl ester
  • Amchem 65-81-b
  • Amiben, methyl ester
  • Benzoic acid, 3-amino-2,5-dichloro-, methylated
  • Chloramben, methyl ester
  • Methyl 3-amino-2,5-dichlorobenzoate
  • Methyl chloramben
  • NSC 190368
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Physical Properties

Property Value Unit Source
ΔfH°gas -327.02 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 25.73 kJ/mol Joback Calculated Property
ΔvapH° 79.64 kJ/mol Relay (1.0) Calculated Property
IE 8.34 eV Relay (1.0) Calculated Property
log10WS -3.26 Aq. Solubility Prediction
logPoct/wat 2.362 Crippen Calculated Property
McVol 141.720 ml/mol McGowan Calculated Property
Pc 3581.35 kPa Joback Calculated Property
Tboil 574.51 K Relay (1.0) Calculated Property
Tfus 335.09 ± 0.50 K NIST

Cheméo can also estimate Critical Temperature, Critical Volume, 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [305.36; 350.84] J/mol×K [647.74; 887.37] Show Hide
Cp,gas 305.36 J/mol×K 647.74 Joback Calculated Property
Cp,gas 314.51 J/mol×K 687.68 Joback Calculated Property
Cp,gas 323.02 J/mol×K 727.62 Joback Calculated Property
Cp,gas 330.92 J/mol×K 767.55 Joback Calculated Property
Cp,gas 338.18 J/mol×K 807.49 Joback Calculated Property
Cp,gas 344.83 J/mol×K 847.43 Joback Calculated Property
Cp,gas 350.84 J/mol×K 887.37 Joback Calculated Property

Similar Compounds

Benzoic acid, 3-amino-2,5-dichloro-. Benzoic acid, 3-amino-2,5-dichloro-. 3-Amino-2,5-dichlorobenzoic acid, N-dimethylaminomethylene-, methyl ester. 3-Amino-2,5-dichlorobenzoic acid, N-dimethylaminomethylene-, ethyl ester. Benzoic acid, 2-amino-5-chloro-, methyl ester. Benzoic acid, 4-amino-2-chloro-, 2-(diethylamino)ethyl ester. 3-Amino-4-chlorobenzoic acid. Benzoic acid, (4-chloro-3-nitrophenyl)methyl ester. Benzoic acid, 2-[(2,6-dichloro-3-methylphenyl)amino]-, methyl ester. Benzoic acid, 3-amino-, methyl ester. 1,3-Benzenedicarboxylic acid, 5-amino-, dimethyl ester. BENZOIC ACID, 2-CHLORO-3,5-DINITRO-. Benzoic acid, 3-(acetylamino)-, methyl ester. Isophthalic acid, monoamide, N-(2-chlorophenyl)-, heptyl ester. Isophthalic acid, monoamide, N-(2-chlorophenyl)-, octyl ester.

Find more compounds similar to Chloramben methyl.

Sources

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