Cas no 2941-44-8 (Hexanedinitrile,2,2-dimethyl-)

Hexanedinitrile,2,2-dimethyl- structure
Hexanedinitrile,2,2-dimethyl- structure
Product Name:Hexanedinitrile,2,2-dimethyl-
CAS No:2941-44-8
MF:C8H12N2
MW:136.194281578064
CID:289213
PubChem ID:264219
Update Time:2025-04-19

Hexanedinitrile,2,2-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • Hexanedinitrile,2,2-dimethyl-
    • 2,2-dimethylhexanedinitrile
    • 2,2-Dimethyl-adiponitril
    • 2,2-dimethyladiponitrile
    • AC1L6BEK
    • AR-1D1543
    • CTK4G3244
    • NCIOpen2_001963
    • NSC99213
    • AKOS014588599
    • SCHEMBL6648740
    • NSC-99213
    • GBRNFMUKXFZFRJ-UHFFFAOYSA-N
    • DTXSID50294997
    • 2941-44-8
    • Inchi: 1S/C8H12N2/c1-8(2,7-10)5-3-4-6-9/h3-5H2,1-2H3
    • InChI Key: GBRNFMUKXFZFRJ-UHFFFAOYSA-N
    • SMILES: N#CC(C)(C)CCCC#N

Computed Properties

  • Exact Mass: 136.10016
  • Monoisotopic Mass: 136.1
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 3
  • Complexity: 186
  • 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: 1.3
  • Topological Polar Surface Area: 47.6?2

Experimental Properties

  • Density: 0.923
  • Boiling Point: 296.5°Cat760mmHg
  • Flash Point: 139.3°C
  • Refractive Index: 1.44
  • PSA: 47.58
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