Cas no 42866-01-3 (N'',N'''-Dodecane-1,12-diylbis(N-cyanoguanidine))

N'',N'''-Dodecane-1,12-diylbis(N-cyanoguanidine) structure
42866-01-3 structure
Product Name:N'',N'''-Dodecane-1,12-diylbis(N-cyanoguanidine)
CAS No:42866-01-3
MF:C16H30N8
MW:334.463001728058
CID:2827415
PubChem ID:14883404
Update Time:2025-04-21

N'',N'''-Dodecane-1,12-diylbis(N-cyanoguanidine) Chemical and Physical Properties

Names and Identifiers

    • DTXCID80515763
    • DTXSID70564987
    • N'',N'''-Dodecane-1,12-diylbis(N-cyanoguanidine)
    • 42866-01-3
    • Inchi: 1S/C16H30N8/c17-13-23-15(19)21-11-9-7-5-3-1-2-4-6-8-10-12-22-16(20)24-14-18/h1-12H2,(H3,19,21,23)(H3,20,22,24)
    • InChI Key: GMIJRVJTDOSERW-UHFFFAOYSA-N
    • SMILES: N(=C(/N)\NC#N)/CCCCCCCCCCCC/N=C(\N)/NC#N

Computed Properties

  • Exact Mass: 334.25934299Da
  • Monoisotopic Mass: 334.25934299Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 15
  • Complexity: 421
  • 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: 148?2
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