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52943-21-2

Basic Information
CAS No.: 52943-21-2
Name: 2-CHLORO-N,N-DIMETHYL-3-PYRIDINECARBOXAMIDE
Article Data: 12
Molecular Structure:
Molecular Structure of 52943-21-2 (2-CHLORO-N,N-DIMETHYL-3-PYRIDINECARBOXAMIDE)
Formula: C8H9ClN2O
Molecular Weight: 184.625
Synonyms: 2-Chloro-N,N-dimethylnicotinamide;N,N-Dimethyl-2-chloronicotinamide;
Density: 1.232 g/cm3
Melting Point: 63-65℃
Boiling Point: 330.673 °C at 760 mmHg
Flash Point: 153.786 °C
PSA: 33.20000
LogP: 1.43680
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Specification

The 2-Chloro-N,N-dimethylnicotinamide with its cas register number is 52943-21-2. It also can be called as  2-Chloro-N,N-dimethyl-3-pyridinecarboxamide and the IUPAC Name about this chemical is 2-chloro-N,N-dimethylpyridine-3-carboxamide. It belongs to the pharmacetical.

Physical properties about 2-Chloro-N,N-dimethylnicotinamide are: (1)ACD/LogP: 0.31; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 42; (5)ACD/KOC (pH 7.4): 42; (6)#H bond acceptors: 3; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 33.2Å2; (9)Index of Refraction: 1.548; (10)Molar Refractivity: 47.621 cm3; (11)Molar Volume: 149.898 cm3; (12)Polarizability: 18.879x10-24cm3; (13)Surface Tension: 44.863 dyne/cm; (14)Enthalpy of Vaporization: 57.327 kJ/mol.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CN(C)C(=O)C1=C(N=CC=C1)Cl
(2)InChI: InChI=1S/C8H9ClN2O/c1-11(2)8(12)6-4-3-5-10-7(6)9/h3-5H,1-2H3
(3)InChIKey: QNZRJGJNLOMEGJ-UHFFFAOYSA-N