Cas no 1173022-97-3 (4-methoxybenzoic acid)

4-methoxybenzoic acid structure
4-methoxybenzoic acid structure
Product Name:4-methoxybenzoic acid
CAS No:1173022-97-3
MF:C8H8O3
MW:158.103251457214
CID:1003510
PubChem ID:71309376
Update Time:2025-04-20

4-methoxybenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 4-methoxybenzoic acid
    • p-Anisic acid-13C6
    • 1173022-97-3
    • HY-N1394S
    • 4-Methoxybenzoic acid-[13C6]
    • DTXSID50745853
    • 4-methoxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1-carboxylic acid
    • 4-Methoxybenzoic acid-(phenyl-13C6), 99 atom % 13C
    • CS-0311970
    • 4-Methoxy(~13~C_6_)benzoic acid
    • Inchi: 1S/C8H8O3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10)/i2+1,3+1,4+1,5+1,6+1,7+1
    • InChI Key: ZEYHEAKUIGZSGI-WBJZHHNVSA-N
    • SMILES: O(C)[13C]1[13CH]=[13CH][13C](C(=O)O)=[13CH][13CH]=1

Computed Properties

  • Exact Mass: 158.06747313g/mol
  • Monoisotopic Mass: 158.06747313g/mol
  • Isotope Atom Count: 6
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 136
  • 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
  • Topological Polar Surface Area: 46.5?2

4-methoxybenzoic acid Pricemore >>

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A2B Chem LLC
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4-Methoxybenzoic acid-[13C6]
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$4913.00 2024-04-20
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