| CAS Number | 2096329-52-9 |
| Catalog Number | AG01EHG3 |
| Chemical Name | 2-Fluoro-3-methoxy-5-methylphenylboronic acid |
| IUPAC Name | (2-fluoro-3-methoxy-5-methylphenyl)boronic acid |
| InChI | InChI=1S/C8H10BFO3/c1-5-3-6(9(11)12)8(10)7(4-5)13-2/h3-4,11-12H,1-2H3 |
| InChI Key | OTXTXRTWSHJYDV-UHFFFAOYSA-N |
| MDL Number | MFCD19440599 |
| Molecular Formula | C8H10BFO3 |
| Molecular Weight | 183.9726 |
| SMILES | COc1cc(C)cc(c1F)B(O)O |
| Synonyms | 2-Fluoro-3-methoxy-5-methylphenylboronic acid,
2096329-52-9,
(2-fluoro-3-methoxy-5-methylphenyl)boronic acid,
MFCD19440599,
ZINC169955447,
Y2331,
B-9302,
C8H10BFO3,
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| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.973g/mol |
| Monoisotopic Mass | 184.071g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 49.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number