| CAS Number | 1417914-09-0 |
| Catalog Number | AG009WUK(AGN-PC-0WA5OK) |
| Chemical Name | 2,4-Dichloro-5-fluorophenylboronic acid |
| IUPAC Name | (2,4-dichloro-5-fluorophenyl)boronic acid |
| InChI | InChI=1S/C6H4BCl2FO2/c8-4-2-5(9)6(10)1-3(4)7(11)12/h1-2,11-12H |
| InChI Key | ZBNJMYLBAZGYFK-UHFFFAOYSA-N |
| MDL Number | MFCD19981520 |
| Molecular Formula | C6H4BCl2FO2 |
| Molecular Weight | 208.8102 |
| SMILES | OB(C1=C(Cl)C=C(Cl)C(F)=C1)O |
| Synonyms | 2,4-Dichloro-5-fluorophenylboronic acid,
1417914-09-0,
SCHEMBL3584961,
MFCD19981520,
AKOS025293786,
ZINC169955237,
FCH1362358,
PC412347,
V3132,
B-9608,
C6H4BCl2FO2,
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| Complexity | 161 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.967g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.804g/mol |
| Monoisotopic Mass | 207.967g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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