Cas no 2840-76-8 (3-amino-4-methoxybenzoic acid)

3-amino-4-methoxybenzoic acid structure
3-amino-4-methoxybenzoic acid structure
Product Name:3-amino-4-methoxybenzoic acid
CAS No:2840-76-8
MF:C8H9NO3
MW:167.161962270737
CID:915080
PubChem ID:17823
Update Time:2025-04-19

3-amino-4-methoxybenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-amino-4-methoxybenzoic acid
    • 3-AMINO-4-METHOXY BENZOIC ACID
    • MFCD00002521
    • DB-022225
    • 3-Amino-4-methoxybenzoicacid
    • 3-Amino-4-anisic acid
    • p-Anisic acid, 3-amino-
    • 3-amino-4-methoxy-benzoic acid
    • 3-Amino-4-methoxybenzoic
    • BENZOIC ACID, 3-AMINO-4-METHOXY-
    • DTXSID70951070
    • NS00049250
    • EN300-49208
    • BBL004466
    • CS-W017841
    • EINECS 220-634-3
    • Kyselina 3-amino-4-methoxybenzoova [Czech]
    • Z274783176
    • 3-amino-methoxy benzoic acid
    • 3-amino4-methoxybenzoic acid
    • SY046669
    • 2-14-00-00360 (Beilstein Handbook Reference)
    • AKOS000103993
    • 3-Amino-4-methoxybenzoic acid, >=98%
    • Kyselina 3-amino-4-methoxybenzoova
    • 3-amino 4-methoxy benzoic acid
    • 4-methoxy-3-aminobenzoic acid
    • STK727187
    • InChI=1/C8H9NO3/c1-12-7-3-2-5(8(10)11)4-6(7)9/h2-4H,9H2,1H3,(H,10,11
    • 5-Carboxy-2-methoxyaniline
    • 2840-76-8
    • AM83070
    • BRN 3243089
    • AC-16291
    • 3-amino4methoxybenzoic acid
    • 3-amino -4-methoxybenzoic acid
    • W-109040
    • SCHEMBL436586
    • 3-amino-4-methoxybenzoic acid; 3-amino-p-anisic acid
    • 3-amino-4-(methyloxy)benzoic acid
    • BS-3909
    • 3-Amino-p-anisic acid
    • A5392
    • 2840-26-8
    • Inchi: 1S/C8H9NO3/c1-12-7-3-2-5(8(10)11)4-6(7)9/h2-4H,9H2,1H3,(H,10,11)
    • InChI Key: FDGAEAYZQQCBRN-UHFFFAOYSA-N
    • SMILES: O(C)C1C=CC(C(=O)O)=CC=1N

Computed Properties

  • Exact Mass: 167.05827
  • Monoisotopic Mass: 167.058243
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 172
  • 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: 0.8
  • Topological Polar Surface Area: 72.6

Experimental Properties

  • PSA: 72.55
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