Cas no 636999-92-3 (BENZENE, 4-(BROMOMETHYL)-1,2-BIS(TRIFLUOROMETHYL)-)

Benzene, 4-(bromomethyl)-1,2-bis(trifluoromethyl)-, is a halogenated aromatic compound featuring a bromomethyl substituent and two trifluoromethyl groups on the benzene ring. This structure imparts high reactivity, particularly in nucleophilic substitution reactions, making it a valuable intermediate in organic synthesis. The presence of trifluoromethyl groups enhances its electron-withdrawing properties, influencing reactivity and stability in various chemical transformations. The bromomethyl moiety serves as a versatile functional handle for further derivatization, enabling applications in pharmaceuticals, agrochemicals, and advanced materials. Its well-defined molecular architecture ensures consistent performance in synthetic routes requiring precise control over electronic and steric effects.
BENZENE, 4-(BROMOMETHYL)-1,2-BIS(TRIFLUOROMETHYL)- structure
636999-92-3 structure
Product Name:BENZENE, 4-(BROMOMETHYL)-1,2-BIS(TRIFLUOROMETHYL)-
CAS No:636999-92-3
MF:C9H5BrF6
MW:307.030422925949
CID:3370753
PubChem ID:85902315
Update Time:2025-10-24

BENZENE, 4-(BROMOMETHYL)-1,2-BIS(TRIFLUOROMETHYL)- Chemical and Physical Properties

Names and Identifiers

    • BENZENE, 4-(BROMOMETHYL)-1,2-BIS(TRIFLUOROMETHYL)-
    • 3,4-Bis(trifluoromethyl)benzyl bromide
    • 636999-92-3
    • OTMDLXNMTOPZNF-UHFFFAOYSA-N
    • SCHEMBL1775215
    • MFCD28727771
    • Inchi： 1S/C9H5BrF6/c10-4-5-1-2-6(8(11,12)13)7(3-5)9(14,15)16/h1-3H,4H2
    • InChI Key： OTMDLXNMTOPZNF-UHFFFAOYSA-N
    • SMILES： C1(C(F)(F)F)=CC=C(CBr)C=C1C(F)(F)F

Computed Properties

  • Exact Mass: 305.94788Da
  • Monoisotopic Mass: 305.94788Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 1
  • Complexity: 233
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.2
  • Topological Polar Surface Area: 0?2

BENZENE, 4-(BROMOMETHYL)-1,2-BIS(TRIFLUOROMETHYL)- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A013009949-250mg
3,4-Bis(trifluoromethyl)benzyl bromide
 636999-92-3 97%
250mg
 $475.20 2023-09-01
Alichem
A013009949-500mg
3,4-Bis(trifluoromethyl)benzyl bromide
 636999-92-3 97%
500mg
 $815.00 2023-09-01
Alichem
A013009949-1g
3,4-Bis(trifluoromethyl)benzyl bromide
 636999-92-3 97%
1g
 $1579.40 2023-09-01

BENZENE, 4-(BROMOMETHYL)-1,2-BIS(TRIFLUOROMETHYL)- Related Literature

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