4-Fluoro-2-(morpholinomethyl)phenylboronic Acid Pinacol Ester - CAS 2096340-33-7
Catalog: |
BB016465 |
Product Name: |
4-Fluoro-2-(morpholinomethyl)phenylboronic Acid Pinacol Ester |
CAS: |
2096340-33-7 |
Synonyms: |
4-[[5-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]morpholine; 4-[[5-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]morpholine |
IUPAC Name: | 4-[[5-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]morpholine |
Description: | 4-Fluoro-2-(morpholinomethyl)phenylboronic Acid Pinacol Ester (CAS# 2096340-33-7 ) is a useful research chemical. |
Molecular Weight: | 321.19 |
Molecular Formula: | C17H25FNO3B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=C(C=C(C=C2)F)CN3CCOCC3 |
InChI: | InChI=1S/C17H25BFNO3/c1-16(2)17(3,4)23-18(22-16)15-6-5-14(19)11-13(15)12-20-7-9-21-10-8-20/h5-6,11H,7-10,12H2,1-4H3 |
InChI Key: | BUXFUVTYXQTWAG-UHFFFAOYSA-N |
Complexity: | 399 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 321.191152 |
Formal Charge: | 0 |
Heavy Atom Count: | 23 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 321.191152 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 30.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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