Cas no 625825-66-3 (Oxazole, 4-(chloromethyl)-2-(2-methylphenyl)-)

Oxazole, 4-(chloromethyl)-2-(2-methylphenyl)- structure
625825-66-3 structure
Product Name:Oxazole, 4-(chloromethyl)-2-(2-methylphenyl)-
CAS No:625825-66-3
MF:C11H10ClNO
MW:207.656201839447
CID:1638721
PubChem ID:22337834
Update Time:2025-04-21

Oxazole, 4-(chloromethyl)-2-(2-methylphenyl)- Chemical and Physical Properties

Names and Identifiers

    • Oxazole, 4-(chloromethyl)-2-(2-methylphenyl)-
    • 625825-66-3
    • AB63769
    • JRNYDWOYNWDJJX-UHFFFAOYSA-N
    • 2-o-tolyl-4-Chloromethyloxazole
    • 4-(Chloromethyl)-2-(2-methylphenyl)oxazole
    • SCHEMBL6487009
    • 4-(CHLOROMETHYL)-2-(2-METHYLPHENYL)-1,3-OXAZOLE
    • DB-152822
    • 4-(chloromethyl)-2-(o-tolyl)oxazole
    • Inchi: 1S/C11H10ClNO/c1-8-4-2-3-5-10(8)11-13-9(6-12)7-14-11/h2-5,7H,6H2,1H3
    • InChI Key: JRNYDWOYNWDJJX-UHFFFAOYSA-N
    • SMILES: ClCC1=COC(C2C=CC=CC=2C)=N1

Computed Properties

  • Exact Mass: 207.0452
  • Monoisotopic Mass: 207.0450916g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 188
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.8
  • Topological Polar Surface Area: 26?2

Experimental Properties

  • PSA: 26.03
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