Product Name

  • Name

    4-chloro-5-(3,5-diphenyl-1H-pyrazol-1-yl)pyridazin-3(2H)-one

  • EINECS
  • CAS No. 94375-42-5
  • Density 1.36 g/cm3
  • Solubility
  • Melting Point
  • Formula C19H13ClN4O
  • Boiling Point
  • Molecular Weight 348.79
  • Flash Point
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 94375-42-5 (4-chloro-5-(3,5-diphenyl-1H-pyrazol-1-yl)pyridazin-3(2H)-one)
  • Hazard Symbols
  • Synonyms 3(2H)-Pyridazinone,4-chloro-5-(3,5-diphenylpyrazol-1-yl)- (7CI);NSC 69053;4-Chloro-5-(3,5-diphenyl-1H-pyrazol-1-yl)pyridazin-3(2H)-one;
  • PSA
  • LogP

3(2H)-Pyridazinone,4-chloro-5-(3,5-diphenyl-1H-pyrazol-1-yl)- Specification

The 3(2H)-Pyridazinone,4-chloro-5-(3,5-diphenyl-1H-pyrazol-1-yl)-, with the CAS registry number 94375-42-5, is also known as NSC 69053. This chemical's molecular formula is C19H13ClN4O and molecular weight is 348.79. What's more, its systematic name is 4-Chloro-5-(3,5-diphenyl-1H-pyrazol-1-yl)pyridazin-3(2H)-one. 

Physical properties of 3(2H)-Pyridazinone,4-chloro-5-(3,5-diphenyl-1H-pyrazol-1-yl)- are: (1)ACD/LogP: 3.80; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 50.49 Å2; (7)Index of Refraction: 1.696; (8)Molar Refractivity: 98.48 cm3; (9)Molar Volume: 255.8 cm3; (10)Polarizability: 39.04×10-24 cm3; (11)Surface Tension: 54.9 dyne/cm; (12)Density: 1.36 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl/C1=C(/C=N\NC1=O)n2nc(cc2c3ccccc3)c4ccccc4
(2)InChI: InChI=1S/C19H13ClN4O/c20-18-17(12-21-22-19(18)25)24-16(14-9-5-2-6-10-14)11-15(23-24)13-7-3-1-4-8-13/h1-12H,(H,22,25)
(3)InChIKey: VYKFOOVZPKSUMZ-UHFFFAOYSA-N

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