2-[[2-Nitro-4-(trifluoromethyl)phenyl]thio]acetic acid
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![2-[[2-Nitro-4-(trifluoromethyl)phenyl]thio]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/05cfcd495abe4f4fb918994722c0b396.png "2-[[2-Nitro-4-(trifluoromethyl)phenyl]thio]acetic acid")
2-[[2-Nitro-4-(trifluoromethyl)phenyl]thio]acetic acid
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CAS No:
728-56-3
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Formula:
C9H6F3NO4S
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Chemical Name:
2-[[2-Nitro-4-(trifluoromethyl)phenyl]thio]acetic acid
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Synonyms:
Acetic acid,2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-;Acetic acid,[(α,α,α-trifluoro-2-nitro-p-tolyl)thio]-;Acetic acid,[[2-nitro-4-(trifluoromethyl)phenyl]thio]-;2-[[2-Nitro-4-(trifluoromethyl)phenyl]thio]acetic acid;(2-Nitro-4-trifluoromethyl-phenylsulfanyl)-acetic acid;2-[[2-Nitro-4-(trifluoromethyl)phenyl]sulfanyl]acetic acid
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CAS No:
Safety Information
20/21/22-36/37/38
22-36/37/39
C
P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, P501
H314
Computed Properties
Molecular Weight:281.21
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:280.99696333
Monoisotopic Mass:280.99696333
Topological Polar Surface Area:108
Heavy Atom Count:18
Complexity:331
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-[[2-Nitro-4-(trifluoromethyl)phenyl]thio]acetic acid
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