Cas no 6680-04-2 (4-Methoxy-2-methylbenzoic acid)

4-Methoxy-2-methylbenzoic acid structure
6680-04-2 structure
Product Name:4-Methoxy-2-methylbenzoic acid
CAS No:6680-04-2
MF:C9H10O3
MW:166.173902988434
CID:964688
Update Time:2023-08-02

4-Methoxy-2-methylbenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 4-methoxy-2-methylbenzoicacid
    • 4-Methoxy-2-methylbenzoic acid
    • 2-methyl-4-methoxybenzoic acid
    • Benzoic acid, 4-methoxy-2-methyl-
    • 4-methoxy-2-methyl-benzoic acid
    • 2-Methyl-p-anisic acid
    • MSVRGYOYISBGTH-UHFFFAOYSA-N
    • 4-Methoxy-o-toluic Acid
    • KSC495K2D
    • 4-methoxy-2-methyl benzoic acid
    • 2-methyl-4-methoxy-benzoic acid
    • 2-methyl-4-(methyloxy)benzoic acid
    • STL169175
    • SBB052683
    • CL8052
    • TRA0062215
    • RTC-0
    • Inchi: 1S/C9H10O3/c1-6-5-7(12-2)3-4-8(6)9(10)11/h3-5H,1-2H3,(H,10,11)
    • InChI Key: MSVRGYOYISBGTH-UHFFFAOYSA-N
    • SMILES: O(C)C1C=CC(C(=O)O)=C(C)C=1

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 167
  • Topological Polar Surface Area: 46.5
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