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(Q82822454)
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English
1-[(4-Bromophenyl)ethynyl]-3-iodobenzene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
381.88541035599997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₄H₈BrI
0 references
canonical SMILES
C1=CC(=CC(=C1)I)C#CC2=CC=C(C=C2)Br
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Identifiers
InChI
InChI=1S/C14H8BrI/c15-13-8-6-11(7-9-13)4-5-12-2-1-3-14(16)10-12/h1-3,6-10H
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InChIKey
HYLUYKXACVMGKI-UHFFFAOYSA-N
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CAS Registry Number
832744-30-6
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PubChem CID
71415709
1 reference
matched by identifier from
InChIKey
InChIKey
HYLUYKXACVMGKI-UHFFFAOYSA-N
UniChem compound ID
60882062
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20835119
1 reference
matched by identifier from
InChIKey
InChIKey
HYLUYKXACVMGKI-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60785861
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