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(Q82425879)
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English
7-Bromo-2-benzofuran-1(3H)-one
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
biogenic isobenzofuran
1 reference
based on heuristic
inferred from SMILES
mass
211.9472915
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₈H₅BrO₂
0 references
canonical SMILES
C1C2=C(C(=CC=C2)Br)C(=O)O1
0 references
Identifiers
InChI
InChI=1S/C8H5BrO2/c9-6-3-1-2-5-4-11-8(10)7(5)6/h1-3H,4H2
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InChIKey
BSKYWJYGAQMPLU-UHFFFAOYSA-N
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CAS Registry Number
105694-44-8
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PubChem CID
13720121
1 reference
matched by identifier from
InChIKey
InChIKey
BSKYWJYGAQMPLU-UHFFFAOYSA-N
UniChem compound ID
65256772
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40547580
1 reference
matched by identifier from
InChIKey
InChIKey
BSKYWJYGAQMPLU-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20498364
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