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CS-W001157 4
Total: USD 88.00

4-(Tert-butyl)benzoyl cyanide

  • CAS No. 179612-25-0

  • Cat. No. CS-1029062
  • Molecule weight187.24
  • Purity≥95%
  • MDL No.None

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

4-(Tert-butyl)benzoyl cyanide|CS-1029062

Structure of 179612-25-0

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General Information

  • CAS No. 179612-25-0
  • Cat. No. CS-1029062
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃NO
  • Molecular Weight 187.24
  • Synonym(s) None
  • SMILES N#CC(=O)C1=CC=C(C=C1)C(C)(C)C

Safety Information

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GHS Pictogram :
GHS No : GHS06,GHS09
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅱ
Hazard Statements : H300-H311+H331-H315-H319-H400
Precautionary Statements : P261-P264-P270-P271-P273-P280-P302+P352-P304+P340-P305+P351+P338-P330-P361+P364-P362+P364-P391-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   40.86
  • LogP   2.69038
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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