Cas no 377053-86-6 (Methyl 3-(4-Bromophenyl)isoxazole-5-carboxylate)

Methyl 3-(4-Bromophenyl)isoxazole-5-carboxylate structure
377053-86-6 structure
Product Name:Methyl 3-(4-Bromophenyl)isoxazole-5-carboxylate
CAS No:377053-86-6
MF:C11H8BrNO3
MW:282.0901222229
MDL:MFCD02737761
CID:1485384
PubChem ID:776529
Update Time:2025-04-21

Methyl 3-(4-Bromophenyl)isoxazole-5-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 3-(4-bromophenyl)-1,2-oxazole-5-carboxylate
    • 3 - (4 - bromine phenyl) different oxazole - 5 - carboxylic acid methyl ester
    • methyl 3-(4-bromophenyl)isoxazole-5-carboxylate
    • DS-19241
    • AKOS001597459
    • Z2050071638
    • STL329331
    • 3-(4-Bromine phenyl) different oxazole-5-carboxylic acid methyl ester
    • EN300-268623
    • CS-0150823
    • A918705
    • F52831
    • SCHEMBL15919469
    • 377053-86-6
    • CCG-106032
    • EU-0070838
    • CQA05386
    • DB-343287
    • methyl3-(4-bromophenyl)isoxazole-5-carboxylate
    • Methyl 3-(4-Bromophenyl)isoxazole-5-carboxylate
    • MDL: MFCD02737761
    • Inchi: 1S/C11H8BrNO3/c1-15-11(14)10-6-9(13-16-10)7-2-4-8(12)5-3-7/h2-6H,1H3
    • InChI Key: FXKDYVHKGFPHBA-UHFFFAOYSA-N
    • SMILES: BrC1C=CC(=CC=1)C1C=C(C(=O)OC)ON=1

Computed Properties

  • Exact Mass: 280.96876g/mol
  • Monoisotopic Mass: 280.96876g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 254
  • 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: 2.9
  • Topological Polar Surface Area: 52.3?2

Experimental Properties

  • Boiling Point: 416.4±35.0°C at 760 mmHg

Methyl 3-(4-Bromophenyl)isoxazole-5-carboxylate Security Information

Methyl 3-(4-Bromophenyl)isoxazole-5-carboxylate Pricemore >>

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