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(Q72493530)
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English
2-Methyl-4-nitrobenzyl alcohol
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
167.058243148
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₈H₉NO₃
0 references
canonical SMILES
CC1=C(C=CC(=C1)[N+](=O)[O-])CO
0 references
Identifiers
InChI
InChI=1S/C8H9NO3/c1-6-4-8(9(11)12)3-2-7(6)5-10/h2-4,10H,5H2,1H3
0 references
InChIKey
PXSWIWNWHAUARP-UHFFFAOYSA-N
0 references
CAS Registry Number
22162-15-8
0 references
PubChem CID
21345674
1 reference
matched by identifier from
InChIKey
InChIKey
PXSWIWNWHAUARP-UHFFFAOYSA-N
UniChem compound ID
55397146
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20612649
1 reference
matched by identifier from
InChIKey
InChIKey
PXSWIWNWHAUARP-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60563404
0 references
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