Cas no 856167-67-4 (5-Bromo-2-isobutylbenzonitrile)

5-Bromo-2-isobutylbenzonitrile structure
856167-67-4 structure
Product Name:5-Bromo-2-isobutylbenzonitrile
CAS No:856167-67-4
MF:C11H12BrN
MW:238.123682022095
MDL:MFCD18910889
CID:1040780
Update Time:2025-04-20

5-Bromo-2-isobutylbenzonitrile Chemical and Physical Properties

Names and Identifiers

    • 5-Bromo-2-isobutylbenzonitrile
    • MDL: MFCD18910889
    • Inchi: 1S/C11H12BrN/c1-8(2)5-9-3-4-11(12)6-10(9)7-13/h3-4,6,8H,5H2,1-2H3
    • InChI Key: LNXBMWBKHDYMAY-UHFFFAOYSA-N
    • SMILES: BrC1C=CC(=C(C#N)C=1)CC(C)C

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2

5-Bromo-2-isobutylbenzonitrile Pricemore >>

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