Cas no 115610-39-4 (Benzoic acid,2-[(2,4-dihydroxybenzoyl)amino]-4-methoxy-)

Benzoic acid,2-[(2,4-dihydroxybenzoyl)amino]-4-methoxy- structure
115610-39-4 structure
Product Name:Benzoic acid,2-[(2,4-dihydroxybenzoyl)amino]-4-methoxy-
CAS No:115610-39-4
MF:C15H13NO6
MW:303.266824483871
CID:207952
PubChem ID:189309
Update Time:2025-04-19

Benzoic acid,2-[(2,4-dihydroxybenzoyl)amino]-4-methoxy- Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,2-[(2,4-dihydroxybenzoyl)amino]-4-methoxy-
    • 2-[(2,4-dihydroxybenzoyl)amino]-4-methoxybenzoic acid
    • 115610-39-4
    • 2-((2,4-Dihydroxybenzoyl)amino)-4-methoxybenzoic acid
    • DTXSID60151148
    • Inchi: 1S/C15H13NO6/c1-22-9-3-5-10(15(20)21)12(7-9)16-14(19)11-4-2-8(17)6-13(11)18/h2-7,17-18H,1H3,(H,16,19)(H,20,21)
    • InChI Key: GLXWWDVTVBGZGZ-UHFFFAOYSA-N
    • SMILES: O(C)C1C=CC(C(=O)O)=C(C=1)NC(C1C=CC(=CC=1O)O)=O

Computed Properties

  • Exact Mass: 303.07429
  • Monoisotopic Mass: 303.074
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 4
  • Complexity: 415
  • 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: 2.6
  • Topological Polar Surface Area: 116?2

Experimental Properties

  • Density: 1.503
  • Boiling Point: 460.7°Cat760mmHg
  • Flash Point: 232.4°C
  • Refractive Index: 1.702
  • PSA: 116.09

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