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Cat. No. Size / Unit Price Qty
CS-W001157 4
Total: USD 88.00

2-(4-Tert-butyl-2,6-dimethylphenyl)acetonitrile

  • CAS No. 84803-57-6

  • Cat. No. CS-0219423
  • Purity≥97%
  • MDL No.None

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

2-(4-Tert-butyl-2,6-dimethylphenyl)acetonitrile|CS-0219423

Structure of 84803-57-6

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General Information

  • CAS No. 84803-57-6
  • Cat. No. CS-0219423
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₉N
  • Molecular Weight 201.31
  • Synonym(s) (4-tert-butyl-2,6-dimethylphenyl)acetonitrile
  • SMILES CC1=C(CC#N)C(=CC(=C1)C(C)(C)C)C

Synthesis

  • Route1
    • null|null
      108-38-3
    • ~%
    • 2-(4-Tert-butyl-2,6-dimethylphenyl)acetonitrile|CS-0219423
      84803-57-6

    References

    • Buu-Hoi; Cagniant Bulletin de la Societe Chimique de France, 1942 , vol. <5> 9, p. 889,892
  • Route2

    References

    • Buu-Hoi; Cagniant Bulletin de la Societe Chimique de France, 1942 , vol. <5> 9, p. 889,892
  • Route3
    • 5-Tert-butyl-2-(chloromethyl)-1,3-dimethylbenzene|CS-0218631
      19387-83-8
    • null|null
      151-50-8
    • ~%
    • 2-(4-Tert-butyl-2,6-dimethylphenyl)acetonitrile|CS-0219423
      84803-57-6

    References

    • Buu-Hoi; Cagniant Bulletin de la Societe Chimique de France, 1942 , vol. <5> 9, p. 889,892

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H312-H330-H410
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   3.66702
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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