Substance
  • Substance Name: 3-methylbenzoic acid
  • Formula: C8H8O2
  • Molecular Weight: 136.15 g/mol
  • Identifiers:
    • casrn: 99-04-7
    • pubchemId: 7418
    • iupacname: 3-methylbenzoic acid
    • inchi: InChI=1S/C8H8O2/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3,(H,9,10)
    • inchikey: GPSDUZXPYCFOSQ-UHFFFAOYSA-N
    • csmiles: CC1=CC(=CC=C1)C(=O)O
    • ismiles: CC1=CC(=CC=C1)C(=O)O
    • wikidataId: Q1241221
    • dsstoxcmpId: DTXCID401617
    • ecnumber: 202-723-9
3-methylbenzoic acid
Systems and Datasets