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3-Pyridinecarboxamide,2-cyano-

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  • Name 3-Pyridinecarboxamide,2-cyano-
  • EINECSN/A
  • CAS No. 23649-22-1
  • Density1.33 g/cm3
  • PSA79.77000
  • LogP0.75248
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC7H5N3O
  • Boiling Point393.5 °C at 760 mmHg
  • Molecular Weight147.1341
  • Flash Point191.8 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 23649-22-1 (2-CYANOPYRIDINE-3-CARBOXAMIDE)
  • Hazard SymbolsN/A
  • SynonymsN/A

3-Pyridinecarboxamide,2-cyano- Specification

The 3-Pyridinecarboxamide,2-cyano-, with the CAS registry number 23649-22-1, is also known as 2-Cyanonicotinamide. It belongs to the product category of Amide. This chemical's molecular formula is C7H5N3O and molecular weight is 147.1341. What's more, its systematic name is called 2-Cyanopyridine-3-carboxamide.

Physical properties about 3-Pyridinecarboxamide,2-cyano- are: (1)#of Rule of 5 Violations: 0; (2)#H bond acceptors: 4; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 1; (5)Polar Surface Area: 79.77 Å2; (6)Index of Refraction: 1.596; (7)Molar Refractivity: 37.48 cm3; (8)Molar Volume: 110.1 cm3; (9)Polarizability: 14.85×10-24 cm3; (10)Surface Tension: 72.8 dyne/cm; (11)Density: 1.33 g/cm3; (12)Flash Point: 191.8 °C; (13)Enthalpy of Vaporization: 64.34 kJ/mol; (14)Boiling Point: 393.5 °C at 760 mmHg; (15)Vapour Pressure: 2.12E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: N#Cc1ncccc1C(N)=O
(2) InChI: InChI=1/C7H5N3O/c8-4-6-5(7(9)11)2-1-3-10-6/h1-3H,(H2,9,11)
(3) InChIKey: YQJOMGUGBDEONW-UHFFFAOYAF

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