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(Q82598819)
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English
Methyl 4-(4,4,4-trifluoro-3-oxobutanoyl)benzoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
274.04529342800004
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₉F₃O₄
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canonical SMILES
COC(=O)C1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F
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Identifiers
InChI
InChI=1S/C12H9F3O4/c1-19-11(18)8-4-2-7(3-5-8)9(16)6-10(17)12(13,14)15/h2-5H,6H2,1H3
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InChIKey
USXKGQWTENBINT-UHFFFAOYSA-N
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CAS Registry Number
1076198-42-9
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PubChem CID
46782149
1 reference
matched by identifier from
InChIKey
InChIKey
USXKGQWTENBINT-UHFFFAOYSA-N
UniChem compound ID
23905555
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50676012
1 reference
matched by identifier from
InChIKey
InChIKey
USXKGQWTENBINT-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20626761
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