Cas no 832076-76-3 (Oxazole, 2-(3-chlorophenyl)-4,5-dimethyl-)

Oxazole, 2-(3-chlorophenyl)-4,5-dimethyl- structure
832076-76-3 structure
Product Name:Oxazole, 2-(3-chlorophenyl)-4,5-dimethyl-
CAS No:832076-76-3
MF:C11H10ClNO
MW:207.656201839447
CID:677072
PubChem ID:12158084
Update Time:2025-04-19

Oxazole, 2-(3-chlorophenyl)-4,5-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • Oxazole, 2-(3-chlorophenyl)-4,5-dimethyl-
    • 2-(3-chlorophenyl)-4,5-dimethyl-1,3-oxazole
    • 832076-76-3
    • DTXSID80478809
    • SCHEMBL5536101
    • Inchi: 1S/C11H10ClNO/c1-7-8(2)14-11(13-7)9-4-3-5-10(12)6-9/h3-6H,1-2H3
    • InChI Key: QZILABBOTGDHQD-UHFFFAOYSA-N
    • SMILES: ClC1=CC=CC(=C1)C1=NC(C)=C(C)O1

Computed Properties

  • Exact Mass: 207.0450916g/mol
  • 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: 1
  • Complexity: 200
  • 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: 3.4
  • Topological Polar Surface Area: 26?2
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