| CAS Number | 1207894-62-9 |
| Catalog Number | AG0090CH(AGN-PC-0WNNQ6) |
| Chemical Name | 4-(4-Benzyloxyphenyl)benzeneboronic acid |
| IUPAC Name | [4-(4-phenylmethoxyphenyl)phenyl]boronic acid |
| InChI | InChI=1S/C19H17BO3/c21-20(22)18-10-6-16(7-11-18)17-8-12-19(13-9-17)23-14-15-4-2-1-3-5-15/h1-13,21-22H,14H2 |
| InChI Key | QNTKEFUYQWYPQF-UHFFFAOYSA-N |
| MDL Number | MFCD07644465 |
| Molecular Formula | C19H17BO3 |
| Molecular Weight | 304.1475 |
| SMILES | OB(c1ccc(cc1)c1ccc(cc1)OCc1ccccc1)O |
| Synonyms | 4-(4-BENZYLOXYPHENYL)BENZENEBORONIC ACID,
1207894-62-9,
4'-Benzyloxybiphenyl-4-boronic acid, 97%,
(4'-(Benzyloxy)-[1,1'-biphenyl]-4-yl)boronic acid,
SCHEMBL2555201,
MFCD07644465,
ZINC169744558,
K-1484,
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| Complexity | 328 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 304.127g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 304.152g/mol |
| Monoisotopic Mass | 304.127g/mol |
| Rotatable Bond Count | 5 |
| 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