2-Fluoro-3-methylbenzoicacid
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2-Fluoro-3-methylbenzoicacid
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CAS No:
315-31-1
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Formula:
C8H7FO2
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Chemical Name:
2-Fluoro-3-methylbenzoicacid
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Synonyms:
2-Fluoro-m-toluicacid;2-FLUORO-3-METHYLBENZOICACID;2-Fluoro-3-methylbenzoicacid98%;Benzoicacid,2-fluoro-3-methyl-;2-Fluoro-3-methylbenzoicacid98%;2-Fluoro-m-toluicacid,3-Carboxy-2-fluorotoluene
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CAS No:
Safety Information
22
Xi: Irritant;
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 8 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
2-Fluoro-3-methylbenzoicacid Use and Manufacturing
General procedure: To a solution of 2-fluorobenzoic acid (4a) (80mg, 0.57mmol) in DMF (4mL) were added Et3N (0.12mL, 0.86mmol), 3, 4, 5-trimethoxyaniline (115mg, 0.63mmol) and HATU (239mg, 0.63mmol). The mixture was stirred for 2h at room temperature and water (40mL) was added. The resulting precipitate was filtered and dried to give 170mg of 5a (98%) as a white solid.To a solution of
Computed Properties
Molecular Weight:154.14
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:154.04300762
Monoisotopic Mass:154.04300762
Topological Polar Surface Area:37.3
Heavy Atom Count:11
Complexity:158
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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