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(Q82316071)
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English
3-bromo-5-phenyl-1H-1,2,4-triazole
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
222.974509292
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₈H₆BrN₃
0 references
canonical SMILES
C1=CC=C(C=C1)C2=NNC(=N2)Br
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Identifiers
InChI
InChI=1S/C8H6BrN3/c9-8-10-7(11-12-8)6-4-2-1-3-5-6/h1-5H,(H,10,11,12)
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InChIKey
SIQJGSXGBGMSOQ-UHFFFAOYSA-N
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CAS Registry Number
15777-59-0
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PubChem CID
12217070
1 reference
matched by identifier from
InChIKey
InChIKey
SIQJGSXGBGMSOQ-UHFFFAOYSA-N
UniChem compound ID
18046041
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20480921
1 reference
matched by identifier from
InChIKey
InChIKey
SIQJGSXGBGMSOQ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20431731
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