Chemical Properties of N-(beta-diethylaminoethyl)-2-chloro-4-aminobenzamide (CAS 840-10-8)

N-(beta-diethylaminoethyl)-2-chloro-4-aminobenzamide

InChI
InChI=1S/C13H20ClN3O/c1-3-17(4-2)8-7-16-13(18)11-6-5-10(15)9-12(11)14/h5-6,9H,3-4,7-8,15H2,1-2H3,(H,16,18)
InChI Key
JXLOEMYUSALHDJ-UHFFFAOYSA-N
Formula
C13H20ClN3O
SMILES
CCN(CC)CCNC(=O)c1ccc(N)cc1Cl
Molecular Weight1
269.77
CAS
840-10-8
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Physical Properties

Property Value Unit Source
ΔfusH° 41.80 kJ/mol Joback Calculated Property
log10WS -2.48 Relay (1.0) Calculated Property
logPoct/wat 1.994 Crippen Calculated Property
McVol 214.020 ml/mol McGowan Calculated Property
Tfus 334.90 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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 [295.50; 673.58] 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 A6.04000e-01
Coefficient B1.28174e+00
Coefficient C-7.86820e-04
Coefficient D1.78060e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 295.50 J/mol×K 273.00 Calculated Property
Cp,gas 363.46 J/mol×K 353.78 Calculated Property
Cp,gas 423.62 J/mol×K 434.56 Calculated Property
Cp,gas 476.54 J/mol×K 515.33 Calculated Property
Cp,gas 522.79 J/mol×K 596.11 Calculated Property
Cp,gas 562.92 J/mol×K 676.89 Calculated Property
Cp,gas 597.50 J/mol×K 757.67 Calculated Property
Cp,gas 627.10 J/mol×K 838.44 Calculated Property
Cp,gas 652.27 J/mol×K 919.22 Calculated Property
Cp,gas 673.58 J/mol×K 1000.00 Calculated Property

Similar Compounds

Benzamide, 4-amino-N-[2-(diethylamino)ethyl]-. Metoclopramide. Bromopride. Tiapride. Lycoramine. (-)-Bunolol, PFB-TMS. 6H-Benzofuro[3a,3,2-ef][2]benzazepin-6-one, 4a,5,9,10,11,12-hexahydro-3-methoxy-11-methyl-, (4aS,8aS)-. Mirtazapine-M (HO-) AC. Mirtazapine-M (nor-HO-) 2AC. Lincomycin. narwedine. Mirtazapine-M (nor-HO-methoxy-) 2AC. Norhydrocodone. N-Acetyl-D-glucosamine, tetrakis(trimethylsilyl) ether (isomer 1). N-Acetyl-D-glucosamine, tetrakis(trimethylsilyl) ether (isomer 2).

Find more compounds similar to N-(beta-diethylaminoethyl)-2-chloro-4-aminobenzamide.

Sources

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