| CAS Number | 1334402-78-6 |
| Catalog Number | AG009WUU(AGN-PC-0WA55B) |
| Chemical Name | 2-(4-Fluorophenoxy)phenylboronic acid |
| IUPAC Name | [2-(4-fluorophenoxy)phenyl]boronic acid |
| InChI | InChI=1S/C12H10BFO3/c14-9-5-7-10(8-6-9)17-12-4-2-1-3-11(12)13(15)16/h1-8,15-16H |
| InChI Key | DUZUFXCNHAMELI-UHFFFAOYSA-N |
| MDL Number | MFCD23381044 |
| Molecular Formula | C12H10BFO3 |
| Molecular Weight | 232.0154 |
| SMILES | Fc1ccc(cc1)Oc1ccccc1B(O)O |
| Synonyms | 2-(4-FLUOROPHENOXY)PHENYLBORONIC ACID,
1334402-78-6,
AKOS025293594,
ZINC170002488,
(2-(4-Fluorophenoxy)phenyl)boronic acid,
PC412467,
Z9700,
K-4192,
C12H10BFO3,
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| Complexity | 232 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.017g/mol |
| Monoisotopic Mass | 232.071g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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