2-[[2-Nitro-4-(trifluoromethyl)phenyl]thio]acetic acid
CAS Registry Number®
728-56-3
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CAS Name
2-[[2-Nitro-4-(trifluoromethyl)phenyl]thio]acetic acidMolecular Formula
C9H6F3NO4SMolecular Mass
281.21Cite this Page
2-[[2-Nitro-4-(trifluoromethyl)phenyl]thio]acetic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=728-56-3 (retrieved ) (CAS RN: 728-56-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
154-155 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C9H6F3NO4S/c10-9(11,12)5-1-2-7(18-4-8(14)15)6(3-5)13(16)17/h1-3H,4H2,(H,14,15)
InChIKey
InChIKey=UKWVKDJZWQVZEH-UHFFFAOYSA-N
SMILES
N(=O)(=O)C1=C(SCC(O)=O)C=CC(C(F)(F)F)=C1
Canonical SMILES
O=C(O)CSC1=CC=C(C=C1N(=O)=O)C(F)(F)F
Other Names for this Substance
- 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
