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(Q82117755)
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English
1-Bromomethyl-2-[(phenylsulfonyl)methyl]benzene
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
323.98196275600003
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₄H₁₃BrO₂S
0 references
canonical SMILES
C1=CC=C(C=C1)S(=O)(=O)CC2=CC=CC=C2CBr
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Identifiers
InChI
InChI=1S/C14H13BrO2S/c15-10-12-6-4-5-7-13(12)11-18(16,17)14-8-2-1-3-9-14/h1-9H,10-11H2
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InChIKey
SYNKYJKCQBVGSL-UHFFFAOYSA-N
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CAS Registry Number
88116-02-3
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PubChem CID
603881
1 reference
matched by identifier from
InChIKey
InChIKey
SYNKYJKCQBVGSL-UHFFFAOYSA-N
UniChem compound ID
6002650
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20345344
1 reference
matched by identifier from
InChIKey
InChIKey
SYNKYJKCQBVGSL-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID70296418
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