5-Bromo-1,3-difluoro-2-(2,2,2-trifluoroethoxy)benzene - CAS 145767-78-8
Catalog: |
BB062035 |
Product Name: |
5-Bromo-1,3-difluoro-2-(2,2,2-trifluoroethoxy)benzene |
CAS: |
145767-78-8 |
Synonyms: |
5-Bromo-1,3-difluoro-2-(2,2,2-trifluoroethoxy)benzene; Benzene, 5-bromo-1,3-difluoro-2-(2,2,2-trifluoroethoxy)-; 5-BROMO-1,3-DIFLUORO-2-(2,2,2-TRIFLUOROETHOCY)BENZENE |
IUPAC Name: | 5-bromo-1,3-difluoro-2-(2,2,2-trifluoroethoxy)benzene |
Description: | 5-Bromo-1,3-difluoro-2-(2,2,2-trifluoroethoxy)benzene |
Molecular Weight: | 291.01 |
Molecular Formula: | C8H4BrF5O |
Canonical SMILES: | C1=C(C=C(C(=C1F)OCC(F)(F)F)F)Br |
InChI: | InChI=1S/C8H4BrF5O/c9-4-1-5(10)7(6(11)2-4)15-3-8(12,13)14/h1-2H,3H2 |
InChI Key: | PKBORPYIKXALHI-UHFFFAOYSA-N |
Complexity: | 198 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 289.93657 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 289.93657 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 9.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.9 |
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