2-Bromo-1,3-bis(difluoromethyl)benzene - CAS 79839-50-2
Catalog: |
BB071980 |
Product Name: |
2-Bromo-1,3-bis(difluoromethyl)benzene |
CAS: |
79839-50-2 |
Synonyms: |
2-bromo-1,3-bis(difluoromethyl)benzene |
IUPAC Name: | 2-bromo-1,3-bis(difluoromethyl)benzene |
Molecular Weight: | 257.03 |
Molecular Formula: | C8H5BrF4 |
Canonical SMILES: | C1=CC(=C(C(=C1)C(F)F)Br)C(F)F |
InChI: | InChI=1S/C8H5BrF4/c9-6-4(7(10)11)2-1-3-5(6)8(12)13/h1-3,7-8H |
InChI Key: | UPWRSDCIZCMBCK-UHFFFAOYSA-N |
Complexity: | 146 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 255.95108 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 255.95108 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 0Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.9 |
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