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(Q82108962)
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Pentachlorophenyl dichloroacetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
373.77962303199996
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₈HCl₇O₂
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canonical SMILES
C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)OC(=O)C(Cl)Cl
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Identifiers
InChI
InChI=1S/C8HCl7O2/c9-1-2(10)4(12)6(5(13)3(1)11)17-8(16)7(14)15/h7H
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InChIKey
KDDDLTRKFSGKHG-UHFFFAOYSA-N
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CAS Registry Number
19745-69-8
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PubChem CID
558110
1 reference
matched by identifier from
InChIKey
InChIKey
KDDDLTRKFSGKHG-UHFFFAOYSA-N
UniChem compound ID
24808675
1 reference
stated in
UniChem
NMRShiftDB structure ID
20201442
1 reference
matched by identifier from
InChIKey
InChIKey
KDDDLTRKFSGKHG-UHFFFAOYSA-N
DSSTox substance ID
DTXSID80339729
1 reference
matched by identifier from
InChIKey
InChIKey
KDDDLTRKFSGKHG-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID70290810
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