3,4-Difluoro-2-trifluoromethyl-bromobenzene - CAS 1242339-23-6
Catalog: |
BB067793 |
Product Name: |
3,4-Difluoro-2-trifluoromethyl-bromobenzene |
CAS: |
1242339-23-6 |
Synonyms: |
1-Bromo-3,4-difluoro-2-(trifluoromethyl)benzene; 6-Bromo-2,3-difluorobenzotrifluoride |
IUPAC Name: | 1-bromo-3,4-difluoro-2-(trifluoromethyl)benzene |
Description: | 3,4-Difluoro-2-trifluoromethyl-bromobenzene is a useful synthetic intermediate. |
Molecular Weight: | 260.99 |
Molecular Formula: | C7H2BrF5 |
Canonical SMILES: | C1=CC(=C(C(=C1F)F)C(F)(F)F)Br |
InChI: | InChI=1S/C7H2BrF5/c8-3-1-2-4(9)6(10)5(3)7(11,12)13/h1-2H |
InChI Key: | DKRBFARXIWUPMN-UHFFFAOYSA-N |
Complexity: | 180 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 259.926 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 259.926 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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