Cas no 1634-69-1 (3-Heptanone,2-(2,4-dinitrophenyl)hydrazone)

3-Heptanone,2-(2,4-dinitrophenyl)hydrazone structure
1634-69-1 structure
Product Name:3-Heptanone,2-(2,4-dinitrophenyl)hydrazone
CAS No:1634-69-1
MF:C13H18N4O4
MW:294.306422710419
CID:235057
PubChem ID:5968382
Update Time:2025-04-19

3-Heptanone,2-(2,4-dinitrophenyl)hydrazone Chemical and Physical Properties

Names and Identifiers

    • 3-Heptanone,2-(2,4-dinitrophenyl)hydrazone
    • N-[(Z)-heptan-3-ylideneamino]-2,4-dinitroaniline
    • 3-Oxoheptan-2,4-dinitrophenylhydrazon
    • AC1NZNJM
    • Ethyl-butyl-keton-2,4-dinitro-phenylhydrazon
    • Heptan-3-on-(2,4-dinitro-phenylhydrazon)
    • heptan-3-one-(2,4-dinitro-phenylhydrazone)
    • NSC115635
    • DTXSID50421544
    • (3Z)-heptan-3-one (2,4-dinitrophenyl)hydrazone
    • SR-01000078285-1
    • 1634-69-1
    • AKOS001571269
    • NSC-115635
    • SR-01000078285
    • (2Z)-1-(2,4-DINITROPHENYL)-2-(HEPTAN-3-YLIDENE)HYDRAZINE
    • Inchi: 1S/C13H18N4O4/c1-3-5-6-10(4-2)14-15-12-8-7-11(16(18)19)9-13(12)17(20)21/h7-9,15H,3-6H2,1-2H3/b14-10-
    • InChI Key: ZYYAHBWEWWDHQZ-UVTDQMKNSA-N
    • SMILES: [O-][N+](C1C=C(C=CC=1N/N=C(/CC)\CCCC)[N+](=O)[O-])=O

Computed Properties

  • Exact Mass: 294.13294
  • Monoisotopic Mass: 294.132805
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 6
  • Complexity: 389
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.9
  • Topological Polar Surface Area: 116

Experimental Properties

  • Density: 1.26
  • Boiling Point: 418.4°Cat760mmHg
  • Flash Point: 206.8°C
  • Refractive Index: 1.578
  • PSA: 110.67
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