| CAS Number | 1311182-72-5 |
| Catalog Number | AG01FPPB(AGN-PC-3H5P28) |
| Chemical Name | Boronic acid, B-[2-[(4-methylphenyl)methoxy]phenyl]- |
| IUPAC Name | [2-[(4-methylphenyl)methoxy]phenyl]boronic acid |
| InChI | InChI=1S/C14H15BO3/c1-11-6-8-12(9-7-11)10-18-14-5-3-2-4-13(14)15(16)17/h2-9,16-17H,10H2,1H3 |
| InChI Key | YOUDZABXDDGGLL-UHFFFAOYSA-N |
| MDL Number | MFCD11540646 |
| Molecular Formula | C14H15BO3 |
| Molecular Weight | 242.0781 |
| SMILES | CC1=CC=C(COC2=CC=CC=C2B(O)O)C=C1 |
| Synonyms | SCHEMBL2559341,
1311182-72-5,
AS-68981,
{2-[(4-methylphenyl)methoxy]phenyl}boronic acid,
(2-[(4-methylphenyl)methoxy]phenyl)boronic acid,
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| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.111424g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.08g/mol |
| Monoisotopic Mass | 242.111424g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 49.7Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number