Cas no 925940-95-0 (5-(3-chlorophenyl)-1,2-oxazole-3-carboxylic Acid)

5-(3-chlorophenyl)-1,2-oxazole-3-carboxylic Acid structure
925940-95-0 structure
Product Name:5-(3-chlorophenyl)-1,2-oxazole-3-carboxylic Acid
CAS No:925940-95-0
MF:C10H6ClNO3
MW:223.612541675568
MDL:MFCD07377104
CID:1973752
PubChem ID:16788585
Update Time:2025-04-21

5-(3-chlorophenyl)-1,2-oxazole-3-carboxylic Acid Chemical and Physical Properties

Names and Identifiers

    • 5-(3-chlorophenyl)isoxazole-3-carboxylic acid
    • 5-(3-Chlorophenyl)-1,2-oxazole-3-carboxylic acid
    • 5-(3-chlorophenyl)isoxazole-3-carboxylicacid
    • EN300-36659
    • DB-306180
    • SCHEMBL2486578
    • DTXSID50588520
    • 5-(3-chloro-phenyl)-isoxazole-3-carboxylic acid
    • 5-(3-Chlorophenyl)-isoxazole-3-carboxylic acid
    • G63538
    • MFCD07377104
    • MSBRAMMMTSCNGV-UHFFFAOYSA-N
    • 925940-95-0
    • Z240119360
    • 5-(3-Chlorophenyl)-3-isoxazolecarboxylic acid, AldrichCPR
    • AKOS000143054
    • DTXCID00539284
    • 5-(3-chlorophenyl)-1,2-oxazole-3-carboxylic Acid
    • MDL： MFCD07377104
    • Inchi： 1S/C10H6ClNO3/c11-7-3-1-2-6(4-7)9-5-8(10(13)14)12-15-9/h1-5H,(H,13,14)
    • InChI Key： MSBRAMMMTSCNGV-UHFFFAOYSA-N
    • SMILES： ClC1=CC=CC(=C1)C1=CC(C(=O)O)=NO1

Computed Properties

  • Exact Mass: 223.0036207g/mol
  • Monoisotopic Mass: 223.0036207g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 249
  • 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: 2.5
  • Topological Polar Surface Area: 63.3?2

Experimental Properties

  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 462.2±35.0 °C at 760 mmHg
  • Flash Point: 233.3±25.9 °C
  • Vapor Pressure: 0.0±1.2 mmHg at 25°C

5-(3-chlorophenyl)-1,2-oxazole-3-carboxylic Acid Security Information

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