| CAS Number | 906665-99-4 |
| Catalog Number | AG00IG95(AGN-PC-0WQZ6Z) |
| Chemical Name | 3,5-Bis(benzyloxy)phenylboronic acid |
| IUPAC Name | [3,5-bis(phenylmethoxy)phenyl]boronic acid |
| InChI | InChI=1S/C20H19BO4/c22-21(23)18-11-19(24-14-16-7-3-1-4-8-16)13-20(12-18)25-15-17-9-5-2-6-10-17/h1-13,22-23H,14-15H2 |
| InChI Key | KRQWRMMUXJAOLH-UHFFFAOYSA-N |
| MDL Number | MFCD27935893 |
| Molecular Formula | C20H19BO4 |
| Molecular Weight | 334.1735 |
| SMILES | OB(c1cc(OCc2ccccc2)cc(c1)OCc1ccccc1)O |
| Synonyms | [3,5-Bis(benzyloxy)phenyl]boronic acid,
906665-99-4,
KRQWRMMUXJAOLH-UHFFFAOYSA-N,
3,5-Di(benzyloxy)phenylboronic acid,
3,5-bis-benzyloxy-phenyl-boronic acid,
ZINC170002444,
|
| Complexity | 337 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 334.138g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 334.178g/mol |
| Monoisotopic Mass | 334.138g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 58.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number