4-(2-Nitrovinyl)phenylboronic acid
Product Information
Molecular Formula
C8H8BNO4
Molecular Weight
192.96
Description
4-(2-Nitrovinyl)phenylboronic acid is a compound of utmost significance in the biomedicine realm and holds tremendous promise for addressing a myriad of afflictions spanning cancer to autoimmune disorders. Distinguished by its exceptional capacity to intricately engage specific cellular entities, this extraordinary agent adeptly governs pivotal biological pathways.
Synonyms
(E)-(4-(2-Nitrovinyl)phenyl)boronic acid; 4-(2-Nitrovinyl)phenylboronic acid; 98555-37-4; [4-[(E)-2-nitroethenyl]phenyl]boronic acid; 4-(2-Nitrovinyl)phenylboronicAcid; 4-(E-2-Nitrovinyl)phenylboronic acid; 4-[(E)-2-NITROVINYL]PHENYLBORONIC ACID; 4-[(E)-2-Nitrovinyl]benzeneboronic acid; TRANS-4-(BETA-NITROVINYL)BENZENEBORONIC ACID; {4-[(E)-2-nitroethenyl]phenyl}boronic acid
IUPAC Name
[4-[(E)-2-nitroethenyl]phenyl]boronic acid
SMILES
B(C1=CC=C(C=C1)C=C[N+](=O)[O-])(O)O
InChI
InChI=1S/C8H8BNO4/c11-9(12)8-3-1-7(2-4-8)5-6-10(13)14/h1-6,11-12H/b6-5+
InChI Key
GMEGTAODWQPCOD-AATRIKPKSA-N
Melting Point
133-138 °C
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
193.0546379 g/mol
Monoisotopic Mass
193.0546379 g/mol
Topological Polar Surface Area
86.3Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
218
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
1
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| EP-3878891-A1 | Dynamic covalent hydrogels, precursors thereof and uses thereof | 2020-03-10 |
| WO-2021180795-A1 | Dynamic covalent hydrogels, precursors thereof and uses thereof | 2020-03-10 |
| CA-3054300-A1 | Curable and solvent soluble formulations and methods of making and using thereof | 2017-02-22 |
| EP-3585824-A2 | Curable and solvent soluble formulations and methods of making and using thereof | 2017-02-22 |
| US-2020062877-A1 | Curable and Solvent Soluble Formulations and Methods of Making and Using Therof | 2017-02-22 |
| WO-2018156766-A2 | Curable and solvent soluble formulations and methods of making and using thereof | 2017-02-22 |
