| CAS Number | 1402238-26-9 |
| Catalog Number | AG009WTV(AGN-PC-0WA8G5) |
| Chemical Name | 2-(3-Chloro-4-fluoro-5-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| IUPAC Name | 2-(3-chloro-4-fluoro-5-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI | InChI=1S/C13H17BClFO2/c1-8-6-9(7-10(15)11(8)16)14-17-12(2,3)13(4,5)18-14/h6-7H,1-5H3 |
| InChI Key | SQMNTCNOVKTKEY-UHFFFAOYSA-N |
| MDL Number | MFCD20231468 |
| Molecular Formula | C13H17BClFO2 |
| Molecular Weight | 270.5353 |
| SMILES | FC1=C(Cl)C=C(C=C1C)B2OC(C)(C)C(O2)(C)C |
| Synonyms | 1402238-26-9,
2-(3-CHLORO-4-FLUORO-5-METHYLPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE,
3-Chloro-4-fluoro-5-methylphenylboronic acid, pinacol ester,
MFCD20231468,
AKOS025293772,
ZINC169955900,
FCH2845877,
PC412307,
K-4524,
3-Chloro-4-fluoro-5-methylphenylboronic acid,pinacol ester,
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| Complexity | 308 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 270.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.535g/mol |
| Monoisotopic Mass | 270.099g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number