3-[(2,2,2-trifluoroacetyl)amino]benzoic acid
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![3-[(2,2,2-trifluoroacetyl)amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/8e789a53d6d14107887034eb230a218d.png "3-[(2,2,2-trifluoroacetyl)amino]benzoic acid")
3-[(2,2,2-trifluoroacetyl)amino]benzoic acid
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CAS No:
4855-05-4
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Formula:
C9H6F3NO3
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Chemical Name:
3-[(2,2,2-trifluoroacetyl)amino]benzoic acid
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Synonyms:
4855-05-4;3-[(trifluoroacetyl)amino]benzoic acid;3-[(2,2,2-trifluoroacetyl)amino]benzoic acid;NSC139079;Benzoicacid, 3-[(2,2,2-trifluoroacetyl)amino]-;SCHEMBL712088;DTXSID50300805;ZINC341305;AKOS000299474;NSC-139079;Benzoic acid, 3-(trifluoroacetylamino)-;DS-010475;3-(2,2,2-Trifluoro-acetylamino)-benzoic acid;A827600;3-[(2,2,2-trifluoro-1-oxoethyl)amino]benzoic acid;3-[2,2,2-tris(fluoranyl)ethanoylamino]benzoic acid;Benzoic acid, 3-[(2,2,2-trifluoroacetyl)amino]-
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CAS No:
3-[(2,2,2-trifluoroacetyl)amino]benzoic acid Basic Attributes
233.14 g/mol
233.02997754 g/mol
139079
DTXSID50300805
Computed Properties
Molecular Weight:233.14
XLogP3:2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:233.02997754
Monoisotopic Mass:233.02997754
Topological Polar Surface Area:66.4
Heavy Atom Count:16
Complexity:290
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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