Cas no 2074-03-5 (2-Heptanone,2-(2,4-dinitrophenyl)hydrazone)

2-Heptanone,2-(2,4-dinitrophenyl)hydrazone structure
2074-03-5 structure
Product Name:2-Heptanone,2-(2,4-dinitrophenyl)hydrazone
CAS No:2074-03-5
MF:C13H18N4O4
MW:294.306422710419
CID:287699
PubChem ID:9555667
Update Time:2025-04-19

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

Names and Identifiers

    • 2-Heptanone,2-(2,4-dinitrophenyl)hydrazone
    • (2E)-1-(2,4-dinitrophenyl)-2-(heptan-2-ylidene)hydrazine; STOCK1S-57604; NSC404135; heptan-2-one-(2,4-dinitro-phenylhydrazone); STK833156; 2-Heptanon-< 2.4-dinitro-phenylhydrazon> ; AKOS001575851; Methyl-pentyl-keton-< 2.4-dinitro-phenylhydrazon> ; 2-Heptanone, (2,4-dinitrophenyl)hydrazone; Heptan-2-on-(2,4-dinitro-phenylhydrazon); n-Amyl-methyl-keton-2.4-dinitro-phenylhydrazon; Heptan-2-on-< 2.4-dinitro-phenylhydrazon&gt
    • NSC404135
    • 2074-03-5
    • (2E)-1-(2,4-dinitrophenyl)-2-(heptan-2-ylidene)hydrazine
    • NSC-404135
    • 2-Heptanone, (2,4-dinitrophenyl)hydrazone
    • AKOS001575851
    • DTXSID60429834
    • SR-01000078495-1
    • SR-01000078495
    • Inchi: 1S/C13H18N4O4/c1-3-4-5-6-10(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: KTYJXSWYTPRVIA-GXDHUFHOSA-N
    • SMILES: [O-][N+](C1C=C(C=CC=1N/N=C(\C)/CCCCC)[N+](=O)[O-])=O

Computed Properties

  • Exact Mass: 294.13294
  • Monoisotopic Mass: 294.133
  • 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: 5
  • Topological Polar Surface Area: 116A^2

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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