Cas no 28354-22-5 (Acetonitrile,2-[(3-methylphenyl)amino]-)

Acetonitrile,2-[(3-methylphenyl)amino]- structure
28354-22-5 structure
Product Name:Acetonitrile,2-[(3-methylphenyl)amino]-
CAS No:28354-22-5
MF:C9H10N2
MW:146.189101696014
CID:279155
PubChem ID:34226
Update Time:2025-04-19

Acetonitrile,2-[(3-methylphenyl)amino]- Chemical and Physical Properties

Names and Identifiers

    • Acetonitrile,2-[(3-methylphenyl)amino]-
    • 2-(3-methylanilino)acetonitrile
    • (3-Methyl-phenylamino)-acetonitril
    • [(3-methylphenyl)amino]acetonitrile
    • < 3-Methyl-phenylamino> -acetonitril
    • 2-(3-methylanilino)-acetonitrile
    • AC1L1R70
    • ACETONITRILE, m-TOLUIDINO-
    • Acetonitrile, m-tolylamino-
    • BRN 2638752
    • CTK4G1291
    • m-Tolylaminoacetonitrile
    • N-Cyanomethyl-3-methylanilin
    • AKOS000253442
    • SCHEMBL11269588
    • 28354-22-5
    • DTXSID60182598
    • Inchi: 1S/C9H10N2/c1-8-3-2-4-9(7-8)11-6-5-10/h2-4,7,11H,6H2,1H3
    • InChI Key: MOQXGUQHBPOHDN-UHFFFAOYSA-N
    • SMILES: N(CC#N)C1C=CC=C(C)C=1

Computed Properties

  • Exact Mass: 146.0845
  • Monoisotopic Mass: 146.084398
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 156
  • 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: 35.8
  • XLogP3: 2.1

Experimental Properties

  • Density: 1.082
  • Boiling Point: 316.9°Cat760mmHg
  • Flash Point: 145.5°C
  • Refractive Index: 1.584
  • PSA: 35.82
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