2-Fluoro-6-methoxy-3-methylphenylboronic acid - CAS 1451392-12-3
Catalog: |
BB065040 |
Product Name: |
2-Fluoro-6-methoxy-3-methylphenylboronic acid |
CAS: |
1451392-12-3 |
Synonyms: |
2-Fluoro-6-methoxy-3-methylphenylboronic acid; (2-Fluoro-6-methoxy-3-methylphenyl)boronic acid |
IUPAC Name: | (2-fluoro-6-methoxy-3-methylphenyl)boronic acid |
Description: | 2-Fluoro-6-methoxy-3-methylphenylboronic acid |
Molecular Weight: | 183.97 |
Molecular Formula: | C8H10BFO3 |
Canonical SMILES: | B(C1=C(C=CC(=C1F)C)OC)(O)O |
InChI: | InChI=1S/C8H10BFO3/c1-5-3-4-6(13-2)7(8(5)10)9(11)12/h3-4,11-12H,1-2H3 |
InChI Key: | RHODPGLYWAVVBN-UHFFFAOYSA-N |
Complexity: | 168 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.0707025 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.0707025 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 49.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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