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CS-W001157 4
Total: USD 88.00

2,4,5-Trimethylbenzonitrile

  • CAS No. 58260-83-6

  • Cat. No. CS-0511743
  • Purity≥98%
  • MDL No.None

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

2,4,5-Trimethylbenzonitrile|CS-0511743

Structure of 58260-83-6

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General Information

  • CAS No. 58260-83-6
  • Cat. No. CS-0511743
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁N
  • Molecular Weight 145.20
  • Synonym(s) None
  • SMILES N#CC1=CC(C)=C(C)C=C1C

Synthesis

  • Route1

    References

    • Rudenko; Salfetnikova; Vasil'ev Russian Journal of Organic Chemistry, 1996 , vol. 32, # 10 p. 1447 - 1470
  • Route2
    • 2-Hydroxy-2-(2,4,5-trimethylphenyl)acetic acid|CS-0344868
      79068-65-8
    • ~%
    • 2,4,5-Trimethylbenzonitrile|CS-0511743
      58260-83-6

    References

    • Liebigs Annalen der Chemie, , # 6 p. 1025 - 1034
  • Route3
    • null|null
      79068-62-5
    • ~%
    • 2,4,5-Trimethylbenzonitrile|CS-0511743
      58260-83-6

    References

    • Liebigs Annalen der Chemie, , # 6 p. 1025 - 1034

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   2.48354
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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