Molecule structure of 6-Chloro-N,N-dimethylnicotinamide (CAS NO.54864-83-4):
Systematic Name: 6-Chloro-N,N-dimethylpyridine-3-carboxamide
Molecular Formula: C8H9ClN2O
Molecular Weight: 184.62 g/mol
CAS Registry Number: 54864-83-4
Index of Refraction: 1.548
Molar Refractivity: 47.62 cm3
Molar Volume: 149.8 cm3
Polarizability: 18.87×10-24 cm3
Surface Tension: 44.8 dyne/cm
Density: 1.231 g/cm3
Flash Point: 153.9 °C
Enthalpy of Vaporization: 57.35 kJ/mol
Boiling Point: 330.9 °C at 760 mmHg
Vapour Pressure: 0.000161 mmHg at 25 °C
SMILES: O=C(c1cnc(Cl)cc1)N(C)C
InChI: InChI=1/C8H9ClN2O/c1-11(2)8(12)6-3-4-7(9)10-5-6/h3-5H,1-2H3
InChIKey: BPMBBXCPGAFTCX-UHFFFAOYAU
Std. InChI: InChI=1S/C8H9ClN2O/c1-11(2)8(12)6-3-4-7(9)10-5-6/h3-5H,1-2H3
Std. InChIKey of 6-Chloro-N,N-dimethylnicotinamide (CAS NO.54864-83-4): BPMBBXCPGAFTCX-UHFFFAOYSA-N
6-Chloro-N,N-dimethylnicotinamide (CAS NO.54864-83-4) is also named as 3-Pyridinecarboxamide, 6-chloro-N,N-dimethyl- ; 6-Chloro-N,N-dimethylpyridine-3-carboxamide .
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