rel-(1R,3S)-3-[2-Oxo-2-[2-(trifluoromethyl)phenyl]ethyl]cyclohexanecarboxylic acid
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![rel-(1R,3S)-3-[2-Oxo-2-[2-(trifluoromethyl)phenyl]ethyl]cyclohexanecarboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7ea94eb4dbb94f0e8c8ec383d5c7ee04.png "rel-(1R,3S)-3-[2-Oxo-2-[2-(trifluoromethyl)phenyl]ethyl]cyclohexanecarboxylic acid")
rel-(1R,3S)-3-[2-Oxo-2-[2-(trifluoromethyl)phenyl]ethyl]cyclohexanecarboxylic acid
structure -
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CAS No:
735275-40-8
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Formula:
C16H17F3O3
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Chemical Name:
rel-(1R,3S)-3-[2-Oxo-2-[2-(trifluoromethyl)phenyl]ethyl]cyclohexanecarboxylic acid
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Synonyms:
Cyclohexanecarboxylic acid,3-[2-oxo-2-[2-(trifluoromethyl)phenyl]ethyl]-,(1R,3S)-rel-;rel-(1R,3S)-3-[2-Oxo-2-[2-(trifluoromethyl)phenyl]ethyl]cyclohexanecarboxylic acid
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CAS No:
rel-(1R,3S)-3-[2-Oxo-2-[2-(trifluoromethyl)phenyl]ethyl]cyclohexanecarboxylic acid Basic Attributes
314.3
314.30
Computed Properties
Molecular Weight:314.30
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:314.11297889
Monoisotopic Mass:314.11297889
Topological Polar Surface Area:54.4
Heavy Atom Count:22
Complexity:419
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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rel-(1R,3S)-3-[2-Oxo-2-[2-(trifluoromethyl)phenyl]ethyl]cyclohexanecarboxylic acid
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