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Methyl 3-fluoro-2-nitrobenzoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
199.1363
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₈H₆FNO₄
0 references
canonical SMILES
COC(=O)C1=C(C(=CC=C1)F)[N+](=O)[O-]
0 references
Identifiers
InChI
InChI=1S/C8H6FNO4/c1-14-8(11)5-3-2-4-6(9)7(5)10(12)13/h2-4H,1H3
0 references
InChIKey
CAEZBCWSCZBLRF-UHFFFAOYSA-N
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CAS Registry Number
1214353-57-7
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PubChem CID
19432020
1 reference
matched by identifier from
InChIKey
InChIKey
CAEZBCWSCZBLRF-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL1979862
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CAEZBCWSCZBLRF-UHFFFAOYSA-N
UniChem compound ID
10923505
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80598773
1 reference
matched by identifier from
InChIKey
InChIKey
CAEZBCWSCZBLRF-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID70549532
0 references
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