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(Q82472353)
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English
[3-(Trifluoromethyl)phenyl]propanedinitrile
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
210.04048282
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₅F₃N₂
0 references
canonical SMILES
C1=CC(=CC(=C1)C(F)(F)F)C(C#N)C#N
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Identifiers
InChI
InChI=1S/C10H5F3N2/c11-10(12,13)9-3-1-2-7(4-9)8(5-14)6-15/h1-4,8H
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InChIKey
SBAZCTOWLFSHSI-UHFFFAOYSA-N
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CAS Registry Number
99726-60-0
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PubChem CID
16037854
1 reference
matched by identifier from
InChIKey
InChIKey
SBAZCTOWLFSHSI-UHFFFAOYSA-N
UniChem compound ID
32812437
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80581281
1 reference
matched by identifier from
InChIKey
InChIKey
SBAZCTOWLFSHSI-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30532046
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