2-(MORPHOLINO)PHENYLBORONIC ACID
Product Information
Molecular Formula
C10H14BNO3
Molecular Weight
207.03
Description
2-(Morpholino)phenylboronic acid is a versatile reagent used in the pharmaceutical industry. It is critical for the synthesis of bioactive compounds in the Suzuki coupling reaction, thereby facilitating the development of therapeutics for cancer and inflammatory diseases.
Synonyms
2-Morpholinophenylboronic acid; (2-morpholin-4-ylphenyl)boronic Acid; 4-morpholinephenylboronicacid; [2-(morpholin-4-yl)phenyl]boronic acid; 2-(morpholino)phenylboronic acid
IUPAC Name
(2-morpholin-4-ylphenyl)boronic acid
SMILES
B(C1=CC=CC=C1N2CCOCC2)(O)O
InChI
InChI=1S/C10H14BNO3/c13-11(14)9-3-1-2-4-10(9)12-5-7-15-8-6-12/h1-4,13-14H,5-8H2
InChI Key
ICRHNMKDEVGGGH-UHFFFAOYSA-N
Flash Point
Not applicable
Safety Information
Hazards
H302
Computed Properties
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
207.1066735 g/mol
Monoisotopic Mass
207.1066735 g/mol
Topological Polar Surface Area
52.9Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
197
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
