| CAS Number | 1262404-82-9 |
| Catalog Number | AG01FKZG(AGN-PC-3H4B0K) |
| Chemical Name | 4,4,5,5-tetramethyl-2-(4-(o-tolyloxymethyl)phenyl)-1,3,2-dioxaborolane |
| IUPAC Name | 4,4,5,5-tetramethyl-2-[4-[(2-methylphenoxy)methyl]phenyl]-1,3,2-dioxaborolane |
| InChI | InChI=1S/C20H25BO3/c1-15-8-6-7-9-18(15)22-14-16-10-12-17(13-11-16)21-23-19(2,3)20(4,5)24-21/h6-13H,14H2,1-5H3 |
| InChI Key | QXEZGNJRKQEFLI-UHFFFAOYSA-N |
| MDL Number | MFCD22493769 |
| Molecular Formula | C20H25BO3 |
| Molecular Weight | 324.2217 |
| SMILES | CC1(OB(OC1(C)C)C1=CC=C(C=C1)COC1=C(C=CC=C1)C)C |
| Synonyms | 1262404-82-9,
AS-55516,
4,4,5,5-tetramethyl-2-(4-(o-tolyloxymethyl)phenyl)-1,3,2-dioxaborolane,
4,4,5,5-tetramethyl-2-{4-[(2-methylphenoxy)methyl]phenyl}-1,3,2-dioxaborolane,
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| Complexity | 399 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 324.19g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 324.227g/mol |
| Monoisotopic Mass | 324.19g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 27.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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