Cas no 1219964-15-4 (4-{3-(Dimethylamino)propylamino}-3-nitrobenzoic acid hydrochloride)

4-{3-(Dimethylamino)propylamino}-3-nitrobenzoic acid hydrochloride structure
1219964-15-4 structure
Product Name:4-{3-(Dimethylamino)propylamino}-3-nitrobenzoic acid hydrochloride
CAS No:1219964-15-4
MF:C12H18ClN3O4
MW:303.742022037506
MDL:MFCD13562659
CID:1079221
PubChem ID:53410037
Update Time:2025-04-20

4-{3-(Dimethylamino)propylamino}-3-nitrobenzoic acid hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 4-{[3-(Dimethylamino)propyl]amino}-3-nitrobenzoic acid hydrochloride
    • 4-((3-(Dimethylamino)propyl)amino)-3-nitrobenzoicacidhydrochloride
    • SB82852
    • 4-((3-(Dimethylamino)propyl)amino)-3-nitrobenzoic acid hydrochloride
    • AKOS015846094
    • 1219964-15-4
    • 4-[3-(dimethylamino)propylamino]-3-nitrobenzoic acid;hydrochloride
    • 4-{3-(Dimethylamino)propylamino}-3-nitrobenzoic acid hydrochloride
    • MDL： MFCD13562659
    • Inchi： 1S/C12H17N3O4.ClH/c1-14(2)7-3-6-13-10-5-4-9(12(16)17)8-11(10)15(18)19;/h4-5,8,13H,3,6-7H2,1-2H3,(H,16,17);1H
    • InChI Key： UIEHYALKNUEYCG-UHFFFAOYSA-N
    • SMILES： Cl.[O-][N+](C1C=C(C(=O)O)C=CC=1NCCCN(C)C)=O

Computed Properties

  • Exact Mass: 303.099
  • Monoisotopic Mass: 303.099
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 7
  • Complexity: 317
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 98.4?2

4-{3-(Dimethylamino)propylamino}-3-nitrobenzoic acid hydrochloride Pricemore >>

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