5-Fluoro-1-methyl-1H-indazol-6-yl-6-boronic Acid - CAS 2096331-06-3
Catalog: |
BB065354 |
Product Name: |
5-Fluoro-1-methyl-1H-indazol-6-yl-6-boronic Acid |
CAS: |
2096331-06-3 |
Synonyms: |
(5-Fluoro-1-methyl-1H-indazol-6-yl)boronic Acid; B- (5- Fluoro- 1- methyl- 1H- indazol- 6- yl) boronic Acid |
IUPAC Name: | (5-fluoro-1-methylindazol-6-yl)boronic acid |
Molecular Weight: | 193.97 |
Molecular Formula: | C8H8BFN2O2 |
Canonical SMILES: | B(C1=CC2=C(C=C1F)C=NN2C)(O)O |
InChI: | InChI=1S/C8H8BFN2O2/c1-12-8-3-6(9(13)14)7(10)2-5(8)4-11-12/h2-4,13-14H,1H3 |
InChI Key: | HUXIINILKOWIAC-UHFFFAOYSA-N |
Complexity: | 220 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 194.0662858 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 194.0662858 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 58.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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