3-Bromo-2-fluorophenylboronic Acid Pinacol Ester - CAS 1400220-51-0
Catalog: |
BB009017 |
Product Name: |
3-Bromo-2-fluorophenylboronic Acid Pinacol Ester |
CAS: |
1400220-51-0 |
Synonyms: |
2-(3-bromo-2-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-(3-bromo-2-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
IUPAC Name: | 2-(3-bromo-2-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
Description: | 3-Bromo-2-fluorophenylboronic Acid Pinacol Ester (CAS# 1400220-51-0 ) is a useful research chemical. |
Molecular Weight: | 300.96 |
Molecular Formula: | C12H15BrFO2B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=C(C(=CC=C2)Br)F |
InChI: | InChI=1S/C12H15BBrFO2/c1-11(2)12(3,4)17-13(16-11)8-6-5-7-9(14)10(8)15/h5-7H,1-4H3 |
InChI Key: | JEUIEKUVZKBRRK-UHFFFAOYSA-N |
Storage: | Inert atmosphere, 2-8 °C |
LogP: | 2.88740 |
Complexity: | 282 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 300.03325 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 300.03325 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 18.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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