5-Chloro-2,4-difluorophenylboronic acid pinacol ester - CAS 1073354-65-0
Catalog: |
BB050284 |
Product Name: |
5-Chloro-2,4-difluorophenylboronic acid pinacol ester |
CAS: |
1073354-65-0 |
Synonyms: |
5-Chloro-2,4-difluorobenzeneboronic acid pinacol ester |
IUPAC Name: | 2-(5-chloro-2,4-difluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
Description: | 5-Chloro-2,4-difluorophenylboronic acid pinacol ester (CAS# 1073354-65-0 ) is a useful research chemical. |
Molecular Weight: | 274.5 |
Molecular Formula: | C12H14BClF2O2 |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C=C2F)F)Cl |
InChI: | InChI=1S/C12H14BClF2O2/c1-11(2)12(3,4)18-13(17-11)7-5-8(14)10(16)6-9(7)15/h5-6H,1-4H3 |
InChI Key: | BSMXVFVYXLZVKL-UHFFFAOYSA-N |
Purity: | 95 % |
Complexity: | 311 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 274.0743439 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 274.0743439 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 18.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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