Cas no 672931-13-4 (2-4-(benzyloxy)-2-methylphenylacetonitrile)

2-4-(benzyloxy)-2-methylphenylacetonitrile structure
672931-13-4 structure
Product Name:2-4-(benzyloxy)-2-methylphenylacetonitrile
CAS No:672931-13-4
MF:C16H15NO
MW:237.296404123306
CID:1715218
PubChem ID:23074439
Update Time:2025-04-21

2-4-(benzyloxy)-2-methylphenylacetonitrile Chemical and Physical Properties

Names and Identifiers

    • Benzeneacetonitrile, 2-methyl-4-(phenylmethoxy)-
    • 2-4-(benzyloxy)-2-methylphenylacetonitrile
    • 672931-13-4
    • Z2049925045
    • 2-[4-(benzyloxy)-2-methylphenyl]acetonitrile
    • EN300-1588144
    • G53667
    • AKOS034135734
    • SCHEMBL3905358
    • 2-(2-methyl-4-phenylmethoxyphenyl)acetonitrile
    • Inchi: 1S/C16H15NO/c1-13-11-16(8-7-15(13)9-10-17)18-12-14-5-3-2-4-6-14/h2-8,11H,9,12H2,1H3
    • InChI Key: QCTSWMZDSNPKNQ-UHFFFAOYSA-N
    • SMILES: O(CC1C=CC=CC=1)C1C=CC(CC#N)=C(C)C=1

Computed Properties

  • Exact Mass: 237.11545
  • Monoisotopic Mass: 237.115364102g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 4
  • Complexity: 287
  • 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: 3.4
  • Topological Polar Surface Area: 33?2

Experimental Properties

  • PSA: 33.02

2-4-(benzyloxy)-2-methylphenylacetonitrile Pricemore >>

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