3-Hydroxy-4-methoxyphenylboronic acid
Product Information
Molecular Formula
C7H9BO4
Molecular Weight
167.95
Description
3-Hydroxy-4-methoxyphenylboronic acid is a remarkable biomedicine compound that unveils its drug development potential for multifarious diseases and conditions. With its profound boronic acid derivation, this compound possesses discernible anticancer and antiviral properties. By adroitly interacting with explicit pathways and receptors, it signifies its efficacy against distinct cancer variants and viral afflictions.
Synonyms
(3-Hydroxy-4-methoxyphenyl)boronic acid; Boronic acid, (3-hydroxy-4-methoxyphenyl)- (9CI); 3-hydroxy-4-methoxybenzeneboronic acid; (3-Hydroxy-4-methoxyphenyl)boronicacid; 3-Hydroxy-4-methoxyphenylboronic acid
IUPAC Name
(3-hydroxy-4-methoxyphenyl)boronic acid
SMILES
B(C1=CC(=C(C=C1)OC)O)(O)O
InChI
InChI=1S/C7H9BO4/c1-12-7-3-2-5(8(10)11)4-6(7)9/h2-4,9-11H,1H3
InChI Key
YOPHDOOHKDJUAM-UHFFFAOYSA-N
Flash Point
Not applicable
Computed Properties
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
168.0593889 g/mol
Monoisotopic Mass
168.0593889 g/mol
Topological Polar Surface Area
69.9Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
141
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
