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CS-W001157 4
Total: USD 88.00

2-(3-Bromo-2-methylphenyl)acetonitrile

  • CAS No. 76574-42-0

  • Cat. No. CS-0153519
  • Purity≥96%
  • MDL No.MFCD18392229

*For research and further manufacturing use only, not for direct human use.

2-(3-Bromo-2-methylphenyl)acetonitrile|CS-0153519

Structure of 76574-42-0

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General Information

  • CAS No. 76574-42-0
  • Cat. No. CS-0153519
  • Purity ≥96%
  • MDL No. MFCD18392229
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈BrN
  • Molecular Weight 210.07
  • Synonym(s) 3-BROMO-2-METHYLPHENYLACETONITRILE
  • SMILES CC1=C(C=CC=C1Br)CC#N

Synthesis

  • Route1
    • null|null
      576-23-8
    • null|null
      151-50-8
    • ~%
    • 2-(2-Bromo-6-methylphenyl)acetonitrile|CS-1008099
      76574-41-9
    • In-stock
      2-(3-Bromo-2-methylphenyl)acetonitrile|CS-0153519
      76574-42-0

    References

    • Bennett, Lawrence R.; Blankley, C. John; Fleming, Robert W.; Smith, Ronald D.; Tessman, Deirdre K. Journal of Medicinal Chemistry, 1981 , vol. 24, # 4 p. 382 - 389

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   2.8236
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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