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(Q82693326)
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English
Methyl 5-(3,5-difluorophenyl)pyridine-3-carboxylate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
249.060134968
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₃H₉F₂NO₂
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canonical SMILES
COC(=O)C1=CN=CC(=C1)C2=CC(=CC(=C2)F)F
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Identifiers
InChI
InChI=1S/C13H9F2NO2/c1-18-13(17)10-2-9(6-16-7-10)8-3-11(14)5-12(15)4-8/h2-7H,1H3
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InChIKey
MGYRDKIIONLNTJ-UHFFFAOYSA-N
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CAS Registry Number
1346691-75-5
1 reference
InChIKey
MGYRDKIIONLNTJ-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=1346691-75-5
PubChem CID
71304431
1 reference
matched by identifier from
InChIKey
InChIKey
MGYRDKIIONLNTJ-UHFFFAOYSA-N
UniChem compound ID
50156070
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50745277
1 reference
matched by identifier from
InChIKey
InChIKey
MGYRDKIIONLNTJ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID80696021
0 references
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