| CAS Number | 2096454-16-7 |
| Catalog Number | AG01EHBI |
| Chemical Name | (3-Chloro-2-fluoro-4-methoxyphenyl)boronic acid |
| IUPAC Name | (3-chloro-2-fluoro-4-methoxyphenyl)boronic acid |
| InChI | InChI=1S/C7H7BClFO3/c1-13-5-3-2-4(8(11)12)7(10)6(5)9/h2-3,11-12H,1H3 |
| InChI Key | QNVXKDSBBKZGJT-UHFFFAOYSA-N |
| MDL Number | MFCD30737491 |
| Molecular Formula | C7H7BClFO3 |
| Molecular Weight | 204.3911 |
| SMILES | COc1ccc(c(c1Cl)F)B(O)O |
| Synonyms | 3-Chloro-2-fluoro-4-methoxyphenylboronic acid,
2096454-16-7,
MFCD30737491,
N/A,
|
| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.016g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.388g/mol |
| Monoisotopic Mass | 204.016g/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