Cas no 36668-76-5 (tert-Butylcyanamide)

tert-Butylcyanamide structure
tert-Butylcyanamide structure
Product Name:tert-Butylcyanamide
CAS No:36668-76-5
MF:C5H10N2
MW:98.1463007926941
MDL:MFCD03939095
CID:1478335
PubChem ID:4179348
Update Time:2025-04-21

tert-Butylcyanamide Chemical and Physical Properties

Names and Identifiers

    • Cyanamide, (1,1-dimethylethyl)-
    • N-(tert-butyl)cyanamide
    • CS-0239612
    • TERT-BUTYL CYANAMIDE
    • 36668-76-5
    • tert-butyl(cyano)amine
    • EN300-216054
    • AKOS011772350
    • t-butylcyanamide
    • Tert-butylcyanamide
    • tert-Butylcyanamide
    • MDL: MFCD03939095
    • Inchi: 1S/C5H10N2/c1-5(2,3)7-4-6/h7H,1-3H3
    • InChI Key: IBQCYUBVFOFMRI-UHFFFAOYSA-N
    • SMILES: N(C#N)C(C)(C)C

Computed Properties

  • Exact Mass: 98.0845
  • Monoisotopic Mass: 98.084398327g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 1
  • Complexity: 90.4
  • 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: 1.4
  • Topological Polar Surface Area: 35.8?2

Experimental Properties

  • PSA: 35.82

tert-Butylcyanamide Pricemore >>

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