| CAS Number | 1451392-91-8 |
| Catalog Number | AG01DDWW |
| Chemical Name | (3,4-Difluoro-2-formylphenyl)boronic acid |
| IUPAC Name | (3,4-difluoro-2-formylphenyl)boronic acid |
| InChI | InChI=1S/C7H5BF2O3/c9-6-2-1-5(8(12)13)4(3-11)7(6)10/h1-3,12-13H |
| InChI Key | LETVLJWTRCPAMR-UHFFFAOYSA-N |
| MDL Number | MFCD23713092 |
| Molecular Formula | C7H5BF2O3 |
| Molecular Weight | 185.9206 |
| SMILES | B(c1ccc(c(c1C=O)F)F)(O)O |
| Synonyms | 3,4-Difluoro-2-formylphenylboronic acid,
(3,4-Difluoro-2-formylphenyl)boronic acid,
1451392-91-8,
MFCD23713092,
AKOS027425697,
ZINC169995119,
AS-55774,
CS-0046236,
Z1380,
Q-8733,
C7H5BF2O3,
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| Complexity | 191 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.03g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.921g/mol |
| Monoisotopic Mass | 186.03g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 57.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number