Product Name

  • Name

    5-Chloroimidazol[1,2-a]pyrimidine

  • EINECS
  • CAS No. 944896-82-6
  • Density 1.514 g/cm3
  • Solubility
  • Melting Point
  • Formula C6H4ClN3
  • Boiling Point
  • Molecular Weight 153.571
  • Flash Point
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 944896-82-6 (5-Chloroimidazol[1,2-a]pyrimidine)
  • Hazard Symbols
  • Synonyms Imidazo[1,2-a]pyrimidine, 5-chloro-;
  • PSA 30.19000
  • LogP 1.38270

5-Chloroimidazo[1,2-a]pyrimidine Specification

The 5-Chloroimidazo[1,2-a]pyrimidine, with the CAS registry number 944896-82-6, is also known as Imidazo[1,2-a]pyrimidine, 5-chloro-. This chemical's molecular formula is C6H4ClN3 and molecular weight is 153.57. What's more, its systematic name is the same with its product name.

Physical properties about 5-Chloroimidazo[1,2-a]pyrimidine are: (1)ACD/LogP: 1.909; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.90; (4)ACD/LogD (pH 7.4): 1.91; (5)ACD/BCF (pH 5.5): 16.21; (6)ACD/BCF (pH 7.4): 16.61; (7)ACD/KOC (pH 5.5): 253.76; (8)ACD/KOC (pH 7.4): 260.10; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 30.19 Å2; (13)Index of Refraction: 1.713; (14)Molar Refractivity: 39.759 cm3; (15)Molar Volume: 101.447 cm3; (16)Polarizability: 15.762×10-24cm3; (17)Surface Tension: 57.1278 dyne/cm; (18)Density: 1.514 g/cm3.

You can still convert the following datas into molecular structure:
(1) SMILES: c1cnc2nccn2c1Cl
(2) InChI: InChI=1S/C6H4ClN3/c7-5-1-2-8-6-9-3-4-10(5)6/h1-4H
(3) InChIKey: XYHBQBIMEMOMTJ-UHFFFAOYSA-N

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