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(Q82525798)
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English
4-(Chloromethyl)-2-methoxy-1-nitrobenzene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
p-nitrophenyl polyketide
1 reference
based on heuristic
inferred from SMILES
mass
201.019270796
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₈H₈ClNO₃
0 references
canonical SMILES
COC1=C(C=CC(=C1)CCl)[N+](=O)[O-]
0 references
Identifiers
InChI
InChI=1S/C8H8ClNO3/c1-13-8-4-6(5-9)2-3-7(8)10(11)12/h2-4H,5H2,1H3
0 references
InChIKey
YPGTXBMNSXUGTA-UHFFFAOYSA-N
0 references
CAS Registry Number
68837-96-7
0 references
PubChem CID
22051619
1 reference
matched by identifier from
InChIKey
InChIKey
YPGTXBMNSXUGTA-UHFFFAOYSA-N
UniChem compound ID
25956097
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40622028
1 reference
matched by identifier from
InChIKey
InChIKey
YPGTXBMNSXUGTA-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID50572782
0 references
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