| CAS Number | 2246693-81-0 |
| Catalog Number | AG01FFY1(AGN-PC-3H4AHP) |
| Chemical Name | 2-(4-((3,5-difluorobenzyl)oxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| IUPAC Name | 2-[4-[(3,5-difluorophenyl)methoxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI | InChI=1S/C19H21BF2O3/c1-18(2)19(3,4)25-20(24-18)14-5-7-17(8-6-14)23-12-13-9-15(21)11-16(22)10-13/h5-11H,12H2,1-4H3 |
| InChI Key | YSLXLHMBAGQNQP-UHFFFAOYSA-N |
| MDL Number | MFCD31916462 |
| Molecular Formula | C19H21BF2O3 |
| Molecular Weight | 346.1760 |
| SMILES | CC1(C)C(C)(C)OB(C2=CC=C(OCC3=CC(F)=CC(F)=C3)C=C2)O1 |
| Synonyms | 2246693-81-0,
AS-55497,
2-(4-((3,5-difluorobenzyl)oxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,
2-{4-[(3,5-difluorophenyl)methoxy]phenyl}-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,
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| Complexity | 426 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 346.155g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 346.181g/mol |
| Monoisotopic Mass | 346.155g/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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