Cas no 17332-58-0 (Benzoic acid,2-[[4-(methoxycarbonyl)phenyl]amino]-)

Benzoic acid,2-[[4-(methoxycarbonyl)phenyl]amino]- structure
17332-58-0 structure
Product Name:Benzoic acid,2-[[4-(methoxycarbonyl)phenyl]amino]-
CAS No:17332-58-0
MF:C15H13NO4
MW:271.268024206162
CID:214280
PubChem ID:205083
Update Time:2025-04-19

Benzoic acid,2-[[4-(methoxycarbonyl)phenyl]amino]- Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,2-[[4-(methoxycarbonyl)phenyl]amino]-
    • 2-(4-methoxycarbonylanilino)benzoic acid
    • 17332-58-0
    • Benzoic acid, 2-((4-(methoxycarbonyl)phenyl)amino)-
    • DTXSID30169593
    • BRN 2868540
    • 4'-Methyl 2,4'-iminodibenzoate
    • Oprea1_342323
    • ITF-203
    • Benzoic acid, 2,4'-iminodi-, 4'-methyl ester
    • Inchi: 1S/C15H13NO4/c1-20-15(19)10-6-8-11(9-7-10)16-13-5-3-2-4-12(13)14(17)18/h2-9,16H,1H3,(H,17,18)
    • InChI Key: AMWRZEUIGAKQDL-UHFFFAOYSA-N
    • SMILES: O(C)C(C1C=CC(=CC=1)NC1C=CC=CC=1C(=O)O)=O

Computed Properties

  • Exact Mass: 271.08449
  • Monoisotopic Mass: 271.08445790g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 5
  • Complexity: 350
  • 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: 4.2
  • Topological Polar Surface Area: 75.6?2

Experimental Properties

  • PSA: 75.63
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