3-chlorothiophene-2-boronic acid

Product Information

Molecular Formula:
C4H4BClO2S
Molecular Weight:
162.40
Description
3-chlorothiophene-2-boronic acid is a key intermediate used in the biomedical industry. It plays a crucial role in the synthesis of various pharmaceuticals and agrochemicals. With its unique properties, it is employed in the development of drugs targeting specific diseases related to boron and thiophene derivatives. This product acts as a building block to create innovative therapeutic solutions for a range of ailments.
Synonyms
(3-Chlorothiophen-2-yl)boronic acid; 3-chlorothiophen-2-ylboronic acid; 3-CHLOROTHIOPHENE-2-BORONICACID; Boronic acid, (3-chloro-2-thienyl)-; (3-Chlorothiophen-2-yl)boronicacid; 3-chlorothiophene-2-boronic acid
IUPAC Name
(3-chlorothiophen-2-yl)boronic acid
Canonical SMILES
B(C1=C(C=CS1)Cl)(O)O
InChI
InChI=1S/C4H4BClO2S/c6-3-1-2-9-4(3)5(7)8/h1-2,7-8H
InChI Key
SFFHGIVONBNWST-UHFFFAOYSA-N
Flash Point
Not applicable

Computed Properties

Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
161.9713584 g/mol
Monoisotopic Mass
161.9713584 g/mol
Topological Polar Surface Area
68.7Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
103
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

Patents

Publication Number Title Priority Date
WO-2020249785-A1 Substituted heteroaromatic pyrazolo-pyridines and their use as glun2b receptor modulators 2019-06-14
US-2021017169-A1 Substituted heteroaromatic pyrazolo-pyridines and their use as glun2b receptor modulators 2019-06-14
TW-202115054-A Substituted heteroaromatic pyrazolo-pyridines and their use as glun2b receptor modulators 2019-06-14
CA-3143276-A1 Substituted heteroaromatic pyrazolo-pyridines and their use as glun2b receptor modulators 2019-06-14
CN-114007610-A Substituted heteroaromatic pyrazolopyridines and their use as modulators of the GLUN2B receptor 2019-06-14
US-2020108071-A1 Imidazopyrimidine derivatives 2018-10-03
WO-2020072656-A1 Imidozopyrimidine derivatives 2018-10-03
EP-3860717-A1 Imidozopyrimidine derivatives 2018-10-03
US-11179397-B2 Imidazopyrimidine derivatives 2018-10-03
JP-2016138175-A Novel compound and dye-sensitized photoelectric conversion element using the compound 2015-01-27
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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