Cas no 267875-57-0 (3-Methyl-benzodisoxazole-5-carbonitrile)

3-Methyl-benzodisoxazole-5-carbonitrile structure
267875-57-0 structure
Product Name:3-Methyl-benzodisoxazole-5-carbonitrile
CAS No:267875-57-0
MF:C9H6N2O
MW:158.15674161911
MDL:MFCD18804967
CID:914624
PubChem ID:23000245
Update Time:2025-09-23

3-Methyl-benzodisoxazole-5-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 1,2-Benzisoxazole-5-carbonitrile,3-methyl-(9CI)
    • 3-Methyl-benzo[d]isoxazole-5-carbonitrile
    • F13597
    • A919879
    • 3-methyl-1,2-benzoxazole-5-carbonitrile
    • 267875-57-0
    • NWXDGVHBELPLLR-UHFFFAOYSA-N
    • AKOS022967210
    • CS-0342056
    • DTXSID401271652
    • 5-cyano-3-methyl-1,2-benzisoxazole
    • SB36299
    • MFCD18804967
    • 3-Methyl-1,2-benzisoxazole-5-carbonitrile
    • 3-Methylbenzo[d]isoxazole-5-carbonitrile
    • SCHEMBL7214017
    • DB-241098
    • AS-47403
    • 3-Methyl-benzodisoxazole-5-carbonitrile
    • MDL: MFCD18804967
    • Inchi: 1S/C9H6N2O/c1-6-8-4-7(5-10)2-3-9(8)12-11-6/h2-4H,1H3
    • InChI Key: NWXDGVHBELPLLR-UHFFFAOYSA-N
    • SMILES: O1C2C=CC(C#N)=CC=2C(C)=N1

Computed Properties

  • Exact Mass: 158.048012819g/mol
  • Monoisotopic Mass: 158.048012819g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 220
  • 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: 1.8
  • Topological Polar Surface Area: 49.8?2

3-Methyl-benzodisoxazole-5-carbonitrile Security Information

  • Storage Condition:(BD285605)

3-Methyl-benzodisoxazole-5-carbonitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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TRC
M437855-10mg
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$ 50.00 2022-06-03
TRC
M437855-50mg
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