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(Q82349622)
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English
3-(4-Methylphenyl)-5-nitro-1,2-benzoxazole
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
254.06914218
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₄H₁₀N₂O₃
0 references
canonical SMILES
CC1=CC=C(C=C1)C2=NOC3=C2C=C(C=C3)[N+](=O)[O-]
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Identifiers
InChI
InChI=1S/C14H10N2O3/c1-9-2-4-10(5-3-9)14-12-8-11(16(17)18)6-7-13(12)19-15-14/h2-8H,1H3
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InChIKey
RKWITXPBGLCKBC-UHFFFAOYSA-N
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CAS Registry Number
66639-55-2
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PubChem CID
12459425
1 reference
matched by identifier from
InChIKey
InChIKey
RKWITXPBGLCKBC-UHFFFAOYSA-N
UniChem compound ID
51208157
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20499114
1 reference
matched by identifier from
InChIKey
InChIKey
RKWITXPBGLCKBC-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID90449924
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