| CAS Number | 1417301-67-7 |
| Catalog Number | AG00ILW6(AGN-PC-0WG3FB) |
| Chemical Name | 2-(3-Fluoro-2-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| IUPAC Name | 2-(3-fluoro-2-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI | InChI=1S/C13H18BFO3/c1-12(2)13(3,4)18-14(17-12)9-7-6-8-10(15)11(9)16-5/h6-8H,1-5H3 |
| InChI Key | OONNDCZIVBSYTG-UHFFFAOYSA-N |
| MDL Number | MFCD16996297 |
| Molecular Formula | C13H18BFO3 |
| Molecular Weight | 252.0896 |
| SMILES | COc1c(F)cccc1B1OC(C(O1)(C)C)(C)C |
| Synonyms | 2-(3-FLUORO-2-METHOXYPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE,
1417301-67-7,
3-FLUORO-2-METHOXYPHENYLBORONIC ACID PINACOL ESTER,
SCHEMBL16100733,
MFCD16996297,
AKOS030632367,
ZINC206185372,
MB20428,
AS-55190,
CS-0029501,
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| Complexity | 293 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 252.133g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 252.092g/mol |
| Monoisotopic Mass | 252.133g/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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Certificate of Analysis
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