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(Q82580299)
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English
Methyl 5-(trifluoromethyl)-1H-pyrrole-2-carboxylate
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
193.1235
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₇H₆F₃NO₂
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canonical SMILES
COC(=O)C1=CC=C(N1)C(F)(F)F
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Identifiers
InChI
InChI=1S/C7H6F3NO2/c1-13-6(12)4-2-3-5(11-4)7(8,9)10/h2-3,11H,1H3
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InChIKey
PQFWTUPLKUNQPO-UHFFFAOYSA-N
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CAS Registry Number
952182-25-1
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PubChem CID
45073280
1 reference
matched by identifier from
InChIKey
InChIKey
PQFWTUPLKUNQPO-UHFFFAOYSA-N
UniChem compound ID
23093156
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60662709
1 reference
matched by identifier from
InChIKey
InChIKey
PQFWTUPLKUNQPO-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60613458
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