Cas no 55741-01-0 (2-[(Dimethylamino)methyl]benzoic Acid)

2-[(Dimethylamino)methyl]benzoic Acid structure
55741-01-0 structure
Product Name:2-[(Dimethylamino)methyl]benzoic Acid
CAS No:55741-01-0
MF:C10H13NO2
MW:179.215722799301
MDL:MFCD08060610
CID:351009
PubChem ID:12124695
Update Time:2025-04-19

2-[(Dimethylamino)methyl]benzoic Acid Chemical and Physical Properties

Names and Identifiers

    • 2-((Dimethylamino)methyl)benzoic acid
    • 2-[(Dimethylamino)methyl]benzoic acid
    • 2-[(Dimethylamino)methyl]benzoic acid hydrochloride
    • 2-[(dimethylamino)methyl]benzoic acid(SALTDATA: HCl)
    • 2-DIMETHYLAMINOMETHYL-BENZOIC ACID
    • Benzoic acid, 2-[(dimethylamino)methyl]-
    • N,N-dimethylphthalamic acid
    • o-dimethylaminomethylbenzoic acid
    • o-N,N-dimethylaminomethylbenzoic acid
    • Benzoic acid, 2-[(dimethylamino)methyl]-, hydrochloride
    • 2-[(Dimethylamino)methyl]benzoicAcid
    • TRA0028614
    • SY024238
    • AB0057663
    • SCHEMBL1421554
    • EN300-58654
    • AS-31352
    • FT-0684191
    • MFCD08060610
    • 55741-01-0
    • A870107
    • AKOS004121891
    • CS-0213439
    • ALBB-015108
    • DB-226971
    • 2-[(Dimethylamino)methyl]benzoic Acid
    • MDL： MFCD08060610
    • Inchi： 1S/C10H13NO2/c1-11(2)7-8-5-3-4-6-9(8)10(12)13/h3-6H,7H2,1-2H3,(H,12,13)
    • InChI Key： WBMZATHVOXPWMU-UHFFFAOYSA-N
    • SMILES： OC(C1C=CC=CC=1CN(C)C)=O

Computed Properties

  • Exact Mass: 179.09500
  • Monoisotopic Mass: 179.094628657g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 180
  • 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: -0.3
  • Topological Polar Surface Area: 40.5

Experimental Properties

  • PSA: 40.54000
  • LogP: 1.44640

2-[(Dimethylamino)methyl]benzoic Acid Security Information

  • HazardClass：IRRITANT

2-[(Dimethylamino)methyl]benzoic Acid Pricemore >>

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2-[(Dimethylamino)methyl]benzoic Acid Production Method

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