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CS-W001157 4
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4-Methyl-2-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzonitrile

  • CAS No. 863868-22-8

  • Cat. No. CS-0341941
  • Purity≥97%
  • MDL No.MFCD12407219

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

4-Methyl-2-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzonitrile|CS-0341941

Structure of 863868-22-8

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General Information

  • CAS No. 863868-22-8
  • Cat. No. CS-0341941
  • Purity ≥97%
  • MDL No. MFCD12407219
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₈BNO₂
  • Molecular Weight 243.11
  • Synonym(s) 4-Methyl-2-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-benzonitrile
  • SMILES CC1=CC(=C(C=C1)C#N)B2OC(C)(C)C(C)(C)O2

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H312-H315-H319-H332-H335
Precautionary Statements : P260-P261-P264-P270-P271-P280-P301+P310-P302+P352-P304+P340-P304+P341-P305+P351+P338-P312-P330-P332+P313-P337+P313-P362+P364-P363-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   42.25
  • LogP   2.1659
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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