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(Q82018226)
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English
2-(2-Bromoethyl)-5-nitro-1H-isoindole-1,3(2H)-dione
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
297.95891880399995
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₇BrN₂O₄
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canonical SMILES
C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CCBr
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Identifiers
InChI
InChI=1S/C10H7BrN2O4/c11-3-4-12-9(14)7-2-1-6(13(16)17)5-8(7)10(12)15/h1-2,5H,3-4H2
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InChIKey
MYLMHXLPHPUQQV-UHFFFAOYSA-N
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CAS Registry Number
6321-16-0
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PubChem CID
233593
1 reference
matched by identifier from
InChIKey
InChIKey
MYLMHXLPHPUQQV-UHFFFAOYSA-N
UniChem compound ID
59032962
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60283599
1 reference
matched by identifier from
InChIKey
InChIKey
MYLMHXLPHPUQQV-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30234750
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NSC number
32327
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