Cas no 67083-70-9 ([(2,3-dimethylphenyl)amino]acetonitrile)

[(2,3-dimethylphenyl)amino]acetonitrile structure
67083-70-9 structure
Product Name:[(2,3-dimethylphenyl)amino]acetonitrile
CAS No:67083-70-9
MF:C10H12N2
MW:160.215682029724
CID:965354
PubChem ID:3017727
Update Time:2025-04-19

[(2,3-dimethylphenyl)amino]acetonitrile Chemical and Physical Properties

Names and Identifiers

    • [(2,3-dimethylphenyl)amino]acetonitrile
    • ((2,3-Dimethylphenyl)amino)acetonitrile
    • 2-(2,3-dimethylanilino)acetonitrile
    • 67083-70-9
    • 2-[(2,3-DIMETHYLPHENYL)AMINO]ACETONITRILE
    • NS00053753
    • QAP2ABS28E
    • Acetonitrile, 2-[(2,3-dimethylphenyl)amino]-
    • SCHEMBL9654816
    • (2,3-Dimethylanilino)acetonitrile
    • AKOS000258741
    • EINECS 266-567-3
    • DTXSID20986115
    • YWJMVRHCDGQFNQ-UHFFFAOYSA-N
    • Inchi: 1S/C10H12N2/c1-8-4-3-5-10(9(8)2)12-7-6-11/h3-5,12H,7H2,1-2H3
    • InChI Key: YWJMVRHCDGQFNQ-UHFFFAOYSA-N
    • SMILES: N(CC#N)C1C=CC=C(C)C=1C

Computed Properties

  • Exact Mass: 160.10016
  • Monoisotopic Mass: 160.100048391g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 180
  • 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: 2.4
  • Topological Polar Surface Area: 35.8?2

Experimental Properties

  • PSA: 35.82

[(2,3-dimethylphenyl)amino]acetonitrile Related Literature

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