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(Q82349390)
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English
1,4-Dimethyl-2,5-dinitrobenzene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
196.048406736
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₈H₈N₂O₄
0 references
canonical SMILES
CC1=CC(=C(C=C1[N+](=O)[O-])C)[N+](=O)[O-]
0 references
Identifiers
InChI
InChI=1S/C8H8N2O4/c1-5-3-8(10(13)14)6(2)4-7(5)9(11)12/h3-4H,1-2H3
0 references
InChIKey
CLJZOFDOLIPFEQ-UHFFFAOYSA-N
0 references
CAS Registry Number
712-32-3
0 references
ChemSpider ID
28538313
0 references
PubChem CID
12456017
1 reference
matched by identifier from
InChIKey
InChIKey
CLJZOFDOLIPFEQ-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL8053279
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CLJZOFDOLIPFEQ-UHFFFAOYSA-N
UniChem compound ID
26245246
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60498989
1 reference
matched by identifier from
InChIKey
InChIKey
CLJZOFDOLIPFEQ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60449799
0 references
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