| CAS Number | 1392150-21-8 |
| Catalog Number | AG01CAEF |
| Chemical Name | 2-[(3,5-Difluorophenyl)Methyl]-4,4,5,5-Tetramethyl-1,3,2-Dioxaborolane |
| IUPAC Name | 2-[(3,5-difluorophenyl)methyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI | InChI=1S/C13H17BF2O2/c1-12(2)13(3,4)18-14(17-12)8-9-5-10(15)7-11(16)6-9/h5-7H,8H2,1-4H3 |
| InChI Key | LGJSPTFUIMJKTA-UHFFFAOYSA-N |
| MDL Number | MFCD31457494 |
| Molecular Formula | C13H17BF2O2 |
| Molecular Weight | 254.0807 |
| SMILES | FC=1C=C(C=C(C1)F)CB1OC(C(O1)(C)C)(C)C |
| Synonyms | 2-[(3,5-difluorophenyl)methyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,
1392150-21-8,
SCHEMBL12467723,
|
| Complexity | 283 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.129g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 254.084g/mol |
| Monoisotopic Mass | 254.129g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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