B-(3-Ethoxy-4-fluorophenyl)boronic acid
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B-(3-Ethoxy-4-fluorophenyl)boronic acid
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CAS No:
900174-65-4
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Formula:
C8H10BFO3
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Chemical Name:
B-(3-Ethoxy-4-fluorophenyl)boronic acid
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Synonyms:
Boronic acid,B-(3-ethoxy-4-fluorophenyl)-;Boronic acid,(3-ethoxy-4-fluorophenyl)-;B-(3-Ethoxy-4-fluorophenyl)boronic acid;3-Ethoxy-4-fluorophenylboronic acid
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CAS No:
Safety Information
IRRITANT
Xi
Irritant
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501
H302
|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
B-(3-Ethoxy-4-fluorophenyl)boronic acid Use and Manufacturing
To a solution of 9A (3.86 g, 17.6 mmol) in THF (60 mL) at -78° C. was added n-BuLi (1.6 M in hexanes, 14.3 mL, 22.8 mmol). The mixture was stirred at -78° C. for 40 min before trimethyl borate (3.63 mL, 33 mmol) was added. The reaction was left stirring from -78° C. to rt over 4 h. It was quenched with 1.0 N HCl (40 mL), extracted with EtOAc, washed with brine and dried over NaTo a solution of 64B (3.86 g, 17.6 mmol) in THF (60 mL) at -78° C. was added n-BuLi (1.6 M in hexanes, 14.3 mL, 22.8 mmol). The mixture was stirred at -78° C. for 40 min before trimethyl borate (3.63 mL, 33 mmol) was added. The reaction was left stirring from -78° C. to rt over 4 h. It was quenched with 1.0 N HCl (40 mL), extracted with EtOAc, washed with brine and dried over Na
suzuki reaction
Computed Properties
Molecular Weight:183.97
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:184.0707025
Monoisotopic Mass:184.0707025
Topological Polar Surface Area:49.7
Heavy Atom Count:13
Complexity:156
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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B-(3-Ethoxy-4-fluorophenyl)boronic acid
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