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(Q82399506)
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English
1-[3-(4-Nitrophenoxy)propyl]-1H-imidazole
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
247.095691276
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₁₃N₃O₃
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canonical SMILES
C1=CC(=CC=C1[N+](=O)[O-])OCCCN2C=CN=C2
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Identifiers
InChI
InChI=1S/C12H13N3O3/c16-15(17)11-2-4-12(5-3-11)18-9-1-7-14-8-6-13-10-14/h2-6,8,10H,1,7,9H2
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InChIKey
GYVYWAUONFWZDV-UHFFFAOYSA-N
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CAS Registry Number
88138-61-8
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PubChem CID
13219128
1 reference
matched by identifier from
InChIKey
InChIKey
GYVYWAUONFWZDV-UHFFFAOYSA-N
UniChem compound ID
51562516
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60529227
1 reference
matched by identifier from
InChIKey
InChIKey
GYVYWAUONFWZDV-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID10480016
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