3-[4-(trifluoromethoxy)phenyl]benzoic acid
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![3-[4-(trifluoromethoxy)phenyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6218325836564aee91c3aa69f4f8cf38.png "3-[4-(trifluoromethoxy)phenyl]benzoic acid")
3-[4-(trifluoromethoxy)phenyl]benzoic acid
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CAS No:
728919-12-8
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Formula:
C14H9F3O3
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Chemical Name:
3-[4-(trifluoromethoxy)phenyl]benzoic acid
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Synonyms:
AMTDA077; 4'-Trifluoromethoxy-biphenyl-3-carboxylic acid;
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CAS No:
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:282.21
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:282.05037863
Monoisotopic Mass:282.05037863
Topological Polar Surface Area:46.5
Heavy Atom Count:20
Complexity:335
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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