Cas no 330558-49-1 (Methyl 3-(4-methoxyphenyl)isoxazole-5-carboxylate)

Methyl 3-(4-methoxyphenyl)isoxazole-5-carboxylate structure
330558-49-1 structure
Product Name:Methyl 3-(4-methoxyphenyl)isoxazole-5-carboxylate
CAS No:330558-49-1
MF:C12H11NO4
MW:233.220043420792
CID:1088387
PubChem ID:776534
Update Time:2025-04-20

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

Names and Identifiers

    • Methyl 3-(4-methoxyphenyl)isoxazole-5-carboxylate
    • AKOS000672312
    • KPGXJKWDFWFKAR-UHFFFAOYSA-N
    • EU-0070858
    • DA-06825
    • methyl 3-(4-methoxyphenyl)-1,2-oxazole-5-carboxylate
    • SR-01000427402-1
    • 330558-49-1
    • Methyl3-(4-methoxyphenyl)isoxazole-5-carboxylate
    • SR-01000427402
    • CS-0332956
    • STL329299
    • SCHEMBL2724085
    • MDL: MFCD01932664
    • Inchi: 1S/C12H11NO4/c1-15-9-5-3-8(4-6-9)10-7-11(17-13-10)12(14)16-2/h3-7H,1-2H3
    • InChI Key: KPGXJKWDFWFKAR-UHFFFAOYSA-N
    • SMILES: O1C(C(=O)OC)=CC(C2C=CC(=CC=2)OC)=N1

Computed Properties

  • Exact Mass: 233.06880783g/mol
  • Monoisotopic Mass: 233.06880783g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 263
  • 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: 2.2
  • Topological Polar Surface Area: 61.6?2

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

  • Storage Condition:Sealed in dry,2-8°C

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

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