6-Benzyloxy-2-fluoropyridine-3-boronic acid - CAS 1637749-70-2
Catalog: |
BB073521 |
Product Name: |
6-Benzyloxy-2-fluoropyridine-3-boronic acid |
CAS: |
1637749-70-2 |
Synonyms: |
6-BENZYLOXY-2-FLUOROPYRIDINE-3-BORONIC ACID; (2-fluoro-6-phenylmethoxypyridin-3-yl)boronic acid; (6-(Benzyloxy)-2-fluoropyridin-3-yl)boronic acid |
IUPAC Name: | (2-fluoro-6-phenylmethoxypyridin-3-yl)boronic acid |
Description: | 6-Benzyloxy-2-fluoropyridine-3-boronic acid |
Molecular Weight: | 247.03 |
Molecular Formula: | C12H11BFNO3 |
Canonical SMILES: | B(C1=C(N=C(C=C1)OCC2=CC=CC=C2)F)(O)O |
InChI: | InChI=1S/C12H11BFNO3/c14-12-10(13(16)17)6-7-11(15-12)18-8-9-4-2-1-3-5-9/h1-7,16-17H,8H2 |
InChI Key: | HQXLQBSXSPWPRR-UHFFFAOYSA-N |
Complexity: | 252 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 247.0816015 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 247.0816015 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 62.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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