Cas no 1166756-86-0 (Methyl 4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)benzoate)

Methyl 4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)benzoate structure
1166756-86-0 structure
Product Name:Methyl 4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)benzoate
CAS No:1166756-86-0
MF:C13H12N2O3
MW:244.245983123779
MDL:MFCD12198880
CID:1056148
PubChem ID:53429642
Update Time:2025-08-03

Methyl 4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)benzoate Chemical and Physical Properties

Names and Identifiers

    • Methyl 4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)benzoate
    • 4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)Benzoic acid methyl ester
    • MFCD12198880
    • A893540
    • DTXSID101213346
    • DB-014697
    • SY005730
    • CS-0441425
    • AC3061
    • AKOS015950574
    • Methyl4-(5-Cyclopropyl-1,2,4-oxadiazol-3-yl)benzoate
    • 1166756-86-0
    • MDL: MFCD12198880
    • Inchi: 1S/C13H12N2O3/c1-17-13(16)10-6-2-8(3-7-10)11-14-12(18-15-11)9-4-5-9/h2-3,6-7,9H,4-5H2,1H3
    • InChI Key: OGWVZWUDZHFDFL-UHFFFAOYSA-N
    • SMILES: O1C(C2CC2)=NC(C2C=CC(C(=O)OC)=CC=2)=N1

Computed Properties

  • Exact Mass: 244.08500
  • Monoisotopic Mass: 244.08479225g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 4
  • Complexity: 311
  • 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: 65.2?2

Experimental Properties

  • PSA: 65.22000
  • LogP: 2.40060

Methyl 4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)benzoate Pricemore >>

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