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(Q82022198)
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English
2-Acetyl-3-nitrobenzoic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
209.1559
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₇NO₅
0 references
canonical SMILES
CC(=O)C1=C(C=CC=C1[N+](=O)[O-])C(=O)O
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Identifiers
InChI
InChI=1S/C9H7NO5/c1-5(11)8-6(9(12)13)3-2-4-7(8)10(14)15/h2-4H,1H3,(H,12,13)
0 references
InChIKey
FWLJWRLEBQQLSX-UHFFFAOYSA-N
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CAS Registry Number
7335-59-3
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PubChem CID
240045
1 reference
matched by identifier from
InChIKey
InChIKey
FWLJWRLEBQQLSX-UHFFFAOYSA-N
UniChem compound ID
51282041
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00286463
1 reference
matched by identifier from
InChIKey
InChIKey
FWLJWRLEBQQLSX-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID00237612
0 references
NSC number
45916
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