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1-(2-Bromophenyl)cyclopropanecarbonitrile

  • CAS No. 124276-75-1

  • Cat. No. CS-0088393
  • Purity≥98%
  • MDL No.MFCD07374407

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

1-(2-Bromophenyl)cyclopropanecarbonitrile|CS-0088393

Structure of 124276-75-1

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General Information

  • CAS No. 124276-75-1
  • Cat. No. CS-0088393
  • Purity ≥98%
  • MDL No. MFCD07374407
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈BrN
  • Molecular Weight 222.08
  • Synonym(s) 1-(2-BROMO-PHENYL)-CYCLOPROPANECARBONITRILE
  • SMILES BrC1=CC=CC=C1C2(C#N)CC2

Description

1-(2-Bromophenyl)cyclopropanecarbonitrile features a brominated phenyl ring fused to a strained cyclopropane core bearing a nitrile group. This configuration imparts high reactivity for transition-metal-catalyzed coupling reactions, enabling efficient construction of complex biaryl architectures under mild conditions. The molecule exhibits excellent stability during storage and handling.

Application

1-(2-Bromophenyl)cyclopropanecarbonitrile serves as a versatile building block in synthetic organic chemistry, enabling efficient construction of biaryl and heterocyclic scaffolds via palladium-catalyzed cross-coupling reactions. The cyclopropyl ring imparts conformational rigidity, while the nitrile group offers polarity and handles diverse transformations. Bench-stable and compatible with standard reaction conditions, it facilitates rapid access to complex architectures relevant to medicinal chemistry and materials science.

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+H332-H315-H319
Precautionary Statements : P261-P264-P270-P271-P280-P304+P340-P330-P362-P501

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   3.00428
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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