Trifluoromethylmandelic acid
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Trifluoromethylmandelic acid
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CAS No:
349-10-0
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Formula:
C9H7F3O3
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Chemical Name:
Trifluoromethylmandelic acid
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Synonyms:
Benzeneacetic acid,α-hydroxy-3-(trifluoromethyl)-;Mandelic acid,3-(trifluoromethyl)-;α-Hydroxy-3-(trifluoromethyl)benzeneacetic acid;Trifluoromethylmandelic acid;3-(Trifluoromethyl)mandelic acid;2-Hydroxy-2-[3-(trifluoromethyl)phenyl]acetic acid;2-Hydroxy-2-(3-trifluoromethylphenyl)ethanoic acid;81601-13-0
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CAS No:
Safety Information
R36/37/38
26-36/37/39
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
Computed Properties
Molecular Weight:220.14
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:220.03472857
Monoisotopic Mass:220.03472857
Topological Polar Surface Area:57.5
Heavy Atom Count:15
Complexity:239
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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