Chemical Properties of Benzamide, 2,5-dichloro-n-cyanomethyl-n-ethyl-3-nitro- (CAS 22978-19-4)

Benzamide, 2,5-dichloro-n-cyanomethyl-n-ethyl-3-nitro-

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InChI
InChI=1S/C11H9Cl2N3O3/c1-2-15(4-3-14)11(17)8-5-7(12)6-9(10(8)13)16(18)19/h5-6H,2,4H2,1H3
InChI Key
OBQYWNIQDKCQKM-UHFFFAOYSA-N
Formula
C11H9Cl2N3O3
SMILES
CCN(CC#N)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1Cl
Molecular Weight1
302.11
CAS
22978-19-4
Sources

Physical Properties

Property Value Unit Source
Δf 251.99 kJ/mol Joback Calculated Property
Δfgas 9.34 kJ/mol Joback Calculated Property
Δfus 43.00 kJ/mol Joback Calculated Property
Δvap 88.97 kJ/mol Joback Calculated Property
logPoct/wat 2.89 Crippen Calculated Property
Pc 2465.36 kPa Joback Calculated Property
Tboil 887.79 K Joback Calculated Property
Tc 1135.95 K Joback Calculated Property
Tfus 628.55 K Joback Calculated Property
Vc 0.77 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 505.71 J/mol×K 887.79 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-CN 1
-Cl 2
=CH- (ring) 2
-NO2 1
>N- 1
=C< (ring) 4
-CH2- 2
-CH3 1
>C=O (nonring) 1

Similar Compounds

Benzamide, 2,5-dichloro-n-cyanomethyl-3-nitro-. Benzamide, 2-chloro-n-cyanomethyl-n-cyclopropyl-4-nitro-. Benzamide, 2-chloro-n-(cyanomethyl)-4-nitro-n-propyl-. Benzamide, 2-chloro-n-(cyanomethyl)-n-cyclohexyl-4-nitro-. Benzamide, 2-chloro-n-(cyanoethyl)-n-methyl-4-nitro-. Benzamide, 2-chloro-n-cyanomethyl-4-nitro-n-phenyl-. 2-Chloro-3,5-dinitrobenzoic acid. Nalbuphine, O,O,O-tris(trimethylsilyl) deriv.. 10-Methoxy-14-methyl-5-oxo-5,7,8,14-tetrahydroindolo[2,3-c]-quinazo-[3,2-a]-pyridine tartrate sesquihydrate. 4-Chloro-3-nitrobenzanilide. Normorphine, bis(trimethylsilyl) ether. Normorphine TMS. Normorphine, N-trimethylsilyl-, bis(trimethylsilyl) ether. 10-Methoxy-14-methyl-5-oxo-5,7,8,14-tetrahydro-indolo-[2,3-c]-quinazo-[3,2,a]-pyridine. Nalorphine, bis(trimethylsilyl) ether.

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