2-Chloro-6-methoxyphenylboronic acid
Product Information
Molecular Formula
C7H8BClO3
Molecular Weight
186.40062
Description
Reactant for:• Suzuki coupling• Preparation of inhibitors of cholesteryl ester transfer protein to raise HDLc levels• Pd-catalyzed Suzuki-Miyaura coupling• Solid-phase synthesis of 2,3,5-trisubstituted indoles
Synonyms
Boronic acid, (2-chloro-6-methoxyphenyl)- (9CI)
IUPAC Name
(2-chloro-6-methoxyphenyl)boronic acid
SMILES
B(C1=C(C=CC=C1Cl)OC)(O)O
InChI
InChI=1S/C7H8BClO3/c1-12-6-4-2-3-5(9)7(6)8(10)11/h2-4,10-11H,1H3
InChI Key
XNWCIDBPLDKKAG-UHFFFAOYSA-N
Melting Point
162-165 °C (lit.)
Flash Point
Not applicable
Purity
98
Computed Properties
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Exact Mass
186.0255020 g/mol
Monoisotopic Mass
186.0255020 g/mol
Topological Polar Surface Area
49.7Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
145
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 |
|---|---|---|
| KR-20220010455-A | Organic light emitting device | 2020-07-17 |
| WO-2022015107-A1 | Organic light-emitting device | 2020-07-17 |
| CN-113801127-A | Oxa-thiaazulene derivatives and their use | 2020-07-07 |
| KR-20210112838-A | Organic light emitting device and composition for organic layer of organic light emitting device | 2020-03-06 |
| CN-113939923-A | Organic light emitting device, method for manufacturing the same, and composition of organic material layer for organic light emitting device | 2019-10-08 |
| CN-113993863-A | Heterocyclic compound, organic light-emitting diode including the same, composition for organic layer of organic light-emitting diode, and method of manufacturing organic light-emitting diode | 2019-10-08 |
| CN-112420964-A | Organic light emitting device, method for manufacturing the same, and composition for organic material layer | 2019-08-23 |
| KR-102143580-B1 | Organic light emitting device, manufacturing method of the same and composition for organic layer of organic light emitting device | 2019-08-23 |
| US-2021057651-A1 | Organic light emitting device, method for manufacturing same and composition for organic material layer | 2019-08-23 |
| WO-2020243459-A1 | Thiadiazolyl derivatives as dna polymerase theta inhibitors | 2019-05-31 |
