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(Q72473195)
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English
Ethyl 5-bromo-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylate
chemical compound
5-Bromo-1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid ethyl ester
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
311.99096787999997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₁₀BrFN₂O₂
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canonical SMILES
CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)F)Br
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Identifiers
InChI
InChI=1S/C12H10BrFN2O2/c1-2-18-12(17)10-7-15-16(11(10)13)9-5-3-8(14)4-6-9/h3-7H,2H2,1H3
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InChIKey
IXYYMEMMUBMROA-UHFFFAOYSA-N
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CAS Registry Number
1082828-31-6
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PubChem CID
53302114
1 reference
matched by identifier from
InChIKey
InChIKey
IXYYMEMMUBMROA-UHFFFAOYSA-N
UniChem compound ID
9630485
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30693303
1 reference
matched by identifier from
InChIKey
InChIKey
IXYYMEMMUBMROA-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30644052
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