1-Bromo-2,5-difluoro-4-methylbenzene - CAS 252004-42-5
Catalog: |
BB062020 |
Product Name: |
1-Bromo-2,5-difluoro-4-methylbenzene |
CAS: |
252004-42-5 |
Synonyms: |
1-bromo-2,5-difluoro-4-methylbenzene; 4-Bromo-2,5-difluorotoluene; 1-bromo-2,5-difluoro-4-methyl-benzene; 2,5-Difluoro-4-bromotoluene |
IUPAC Name: | 1-bromo-2,5-difluoro-4-methylbenzene |
Description: | 1-Bromo-2,5-difluoro-4-methylbenzene |
Molecular Weight: | 207.02 |
Molecular Formula: | C7H5BrF2 |
Canonical SMILES: | CC1=CC(=C(C=C1F)Br)F |
InChI: | InChI=1S/C7H5BrF2/c1-4-2-7(10)5(8)3-6(4)9/h2-3H,1H3 |
InChI Key: | DZTNEQVEYQORQO-UHFFFAOYSA-N |
Complexity: | 118 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.95427 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.95427 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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