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(Q63396213)
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English
(2,3,5-trichlorophenyl) acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
237.93551244
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₈H₅Cl₃O₂
0 references
canonical SMILES
CC(=O)OC1=CC(=CC(=C1Cl)Cl)Cl
0 references
Identifiers
InChI
InChI=1S/C8H5Cl3O2/c1-4(12)13-7-3-5(9)2-6(10)8(7)11/h2-3H,1H3
0 references
InChIKey
YHKQUZSHMROARS-UHFFFAOYSA-N
0 references
CAS Registry Number
61925-88-0
0 references
PubChem CID
147510
1 reference
matched by identifier from
InChIKey
InChIKey
YHKQUZSHMROARS-UHFFFAOYSA-N
UniChem compound ID
56713827
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-Fac_Eng_Univ_Tokyo-JP007521
0 references
DSSTox substance ID
DTXSID90210959
2 references
stated in
Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard
matched by identifier from
InChIKey
InChIKey
YHKQUZSHMROARS-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID70133450
0 references
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