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(Q82131754)
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English
1-[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]ethanone
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
254.123069572
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₃H₁₆F₂N₂O
0 references
canonical SMILES
CC(=O)N1CCN(CC1)CC2=C(C=C(C=C2)F)F
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Identifiers
InChI
InChI=1S/C13H16F2N2O/c1-10(18)17-6-4-16(5-7-17)9-11-2-3-12(14)8-13(11)15/h2-3,8H,4-7,9H2,1H3
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InChIKey
IPZKCIJUGHKLOD-UHFFFAOYSA-N
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CAS Registry Number
416894-09-2
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PubChem CID
757812
1 reference
matched by identifier from
InChIKey
InChIKey
IPZKCIJUGHKLOD-UHFFFAOYSA-N
UniChem compound ID
4307636
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80353905
1 reference
matched by identifier from
InChIKey
InChIKey
IPZKCIJUGHKLOD-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID90304968
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