Cas no 13029-24-8 (1-Naphthalenamine, 2,4-dinitro-)

1-Naphthalenamine, 2,4-dinitro- structure
13029-24-8 structure
Product Name:1-Naphthalenamine, 2,4-dinitro-
CAS No:13029-24-8
MF:C10H7N3O4
MW:233.180281877518
CID:96785
PubChem ID:253526
Update Time:2025-04-18

1-Naphthalenamine, 2,4-dinitro- Chemical and Physical Properties

Names and Identifiers

    • 1-Naphthalenamine, 2,4-dinitro-
    • 2,4-dinitronaphthalen-1-amine
    • 1-NaphthalenaMine,2,4-dinitro-
    • 2,4-Dinitro-1-naphthylamine
    • FT-0697527
    • SCHEMBL8687725
    • DTXSID80291575
    • 13029-24-8
    • 2.4-Dinitro-1-naphthylamin
    • Inchi: 1S/C10H7N3O4/c11-10-7-4-2-1-3-6(7)8(12(14)15)5-9(10)13(16)17/h1-5H,11H2
    • InChI Key: UNYLUEQYSSXEBR-UHFFFAOYSA-N
    • SMILES: [O-][N+](C1C=C(C(=C2C=CC=CC2=1)N)[N+](=O)[O-])=O

Computed Properties

  • Exact Mass: 233.04371
  • Monoisotopic Mass: 233.044
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 0
  • Complexity: 325
  • 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: 2.7
  • Topological Polar Surface Area: 118?2

Experimental Properties

  • PSA: 112.3
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