2-Bromo-6-(trifluoromethyl)pyridine-3-boronic acid - CAS 1688675-75-3
Catalog: |
BB071502 |
Product Name: |
2-Bromo-6-(trifluoromethyl)pyridine-3-boronic acid |
CAS: |
1688675-75-3 |
Synonyms: |
2-BROMO-6-(TRIFLUOROMETHYL)PYRIDINE-3-BORONIC ACID; (2-Bromo-6-(trifluoromethyl)pyridin-3-yl)boronic acid; [2-bromo-6-(trifluoromethyl)pyridin-3-yl]boronic acid; 2-Bromo-6-(trifluoromethyl)pyridin-3-boronic acid; (2-Bromo-6-(trifluoromethyl)pyridin-3-yl)boronicacid |
IUPAC Name: | [2-bromo-6-(trifluoromethyl)pyridin-3-yl]boronic acid |
Description: | 2-Bromo-6-(trifluoromethyl)pyridine-3-boronic acid |
Molecular Weight: | 269.81 |
Molecular Formula: | C6H4BBrF3NO2 |
Canonical SMILES: | B(C1=C(N=C(C=C1)C(F)(F)F)Br)(O)O |
InChI: | InChI=1S/C6H4BBrF3NO2/c8-5-3(7(13)14)1-2-4(12-5)6(9,10)11/h1-2,13-14H |
InChI Key: | JOILGSAIOVLPNJ-UHFFFAOYSA-N |
Complexity: | 204 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 268.94706 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 268.94706 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 53.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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