4-[3-(Trifluoromethyl)phenoxy]butanoic acid
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![4-[3-(Trifluoromethyl)phenoxy]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/15d90a165a7e4373a9db19203adc8edd.png "4-[3-(Trifluoromethyl)phenoxy]butanoic acid")
4-[3-(Trifluoromethyl)phenoxy]butanoic acid
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CAS No:
87411-31-2
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Formula:
C11H11F3O3
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Chemical Name:
4-[3-(Trifluoromethyl)phenoxy]butanoic acid
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Synonyms:
Butanoic acid,4-[3-(trifluoromethyl)phenoxy]-;4-[3-(Trifluoromethyl)phenoxy]butanoic acid
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CAS No:
Characteristics
46.53000
2.94900
1.298±0.06 g/cm3
54-55 °C @ Solvent: Heptane
352.6±42.0 °C(Predicted)
4.59±0.10
Computed Properties
Molecular Weight:248.20
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:248.06602869
Monoisotopic Mass:248.06602869
Topological Polar Surface Area:46.5
Heavy Atom Count:17
Complexity:253
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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