Cas no 298201-37-3 (Cyanamide,methylpentyl- (9CI))

Cyanamide,methylpentyl- (9CI) structure
Cyanamide,methylpentyl- (9CI) structure
Product Name:Cyanamide,methylpentyl- (9CI)
CAS No:298201-37-3
MF:C7H14N2
MW:126.199461460114
CID:249281
Update Time:2024-01-26

Cyanamide,methylpentyl- (9CI) Chemical and Physical Properties

Names and Identifiers

    • Cyanamide,methylpentyl- (9CI)
    • Cyanamide, methylpentyl- (9CI)
    • Inchi: 1S/C7H14N2/c1-3-4-5-6-9(2)7-8/h3-6H2,1-2H3
    • InChI Key: PKTZVOBNXLNLGJ-UHFFFAOYSA-N
    • SMILES: N(C)(CCCCC)C#N

Computed Properties

  • Exact Mass: 126.11582
  • Monoisotopic Mass: 126.116
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 4
  • Complexity: 101
  • 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
  • Topological Polar Surface Area: 27A^2

Experimental Properties

  • PSA: 27.03
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