Description
4-Chloro-2-fluoro-3-methoxyphenylboronic acid (CAS No. 944129-07-1) is a high-purity boronic acid derivative with the molecular formula C7H7BClFO3. This compound is a versatile building block in organic synthesis, particularly in Suzuki-Miyaura cross-coupling reactions, enabling the formation of carbon-carbon bonds for pharmaceutical and agrochemical applications. Its IUPAC name is (4-chloro-2-fluoro-3-methoxyphenyl)boronic acid, and it features a chloro-fluoro-methoxy substitution pattern that enhances reactivity and selectivity in coupling reactions. Suitable for researchers and industrial scientists, this boronic acid is rigorously tested for purity and stability, ensuring optimal performance in synthetic workflows. Available in various packaging options to meet lab-scale and bulk requirements.
Properties
- CAS Number: 944129-07-1
- Complexity: 172
- IUPAC Name: (4-chloro-2-fluoro-3-methoxy-phenyl)boronic acid
- InChI: InChI=1S/C7H7BClFO3/c1-13-7-5(9)3-2-4(6(7)10)8(11)12/h2-3,11-12H,1H3
- InChI Key: GDJCQSNQOHRAGY-UHFFFAOYSA-N
- Exact Mass: 204.0160801
- Molecular Formula: C7H7BClFO3
- Molecular Weight: 204.39
- SMILES: B(C1=C(C(=C(C=C1)Cl)OC)F)(O)O
- Topological: 49.7
- Monoisotopic Mass: 204.0160801
- Synonyms: 4-CHLORO-2-FLUORO-3-METHOXYPHENYLBORONIC ACID, EC 696-001-4, 696-001-4, 944129-07-1, (4-Chloro-2-fluoro-3-methoxyphenyl)boronic acid, 4-Chloro-2-fluoro-3-methoxyphenyl boronic acid, MFCD17015742, (4-Chloro-2-fluoro-3-methoxyphenyl)boronicacid, (4-chloro-2-fluoro-3-methoxyphenyl)-boronic acid, SCHEMBL718784, DTXSID20657510, GDJCQSNQOHRAGY-UHFFFAOYSA-N, STR11013, AKOS015850507, DB-357976, CS-0129362, NS00002684, EN300-706100, (4-chloro-2-fluoro-3-methoxy-phenyl)boronic acid, Z1269213973
Application
4-Chloro-2-fluoro-3-methoxyphenylboronic acid is widely used in pharmaceutical research as a key intermediate in the synthesis of bioactive molecules. Its boronic acid moiety facilitates Suzuki-Miyaura cross-coupling reactions, critical for constructing complex aryl-aryl bonds. This compound is also employed in material science for developing advanced polymers and ligands. Additionally, its unique substitution pattern makes it valuable in agrochemical applications for designing novel pesticides and herbicides.
Safety and Hazards
GHS Hazard Statements
- H319 (98.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statements
- P264+P265, P280, P305+P351+P338, and P337+P317
Hazard Classes and Categories
- Eye Irrit. 2A (98.3%)
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