| CAS Number | 2121511-98-4 |
| Catalog Number | AG01ELFX |
| Chemical Name | 2-(3-Bromo-6-fluoro-2-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| IUPAC Name | 2-(3-bromo-6-fluoro-2-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI | InChI=1S/C13H17BBrFO3/c1-12(2)13(3,4)19-14(18-12)10-9(16)7-6-8(15)11(10)17-5/h6-7H,1-5H3 |
| InChI Key | XWKYQMRVZYFAQL-UHFFFAOYSA-N |
| MDL Number | MFCD29088210 |
| Molecular Formula | C13H17BBrFO3 |
| Molecular Weight | 330.9857 |
| SMILES | c1(ccc(c(c1OC)B1OC(C(O1)(C)C)(C)C)F)Br |
| Synonyms | 3-Bromo-6-fluoro-2-methoxyphenylboronic acid pinacol ester,
2-(3-bromo-6-fluoro-2-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,
2121511-98-4,
MFCD29088210,
N/A,
|
| Complexity | 324 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 330.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 330.988g/mol |
| Monoisotopic Mass | 330.044g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 27.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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