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(Q83087948)
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English
Benzeneheptanoic acid, gamma, zeta-dioxo-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
234.089208928
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₃H₁₄O₄
0 references
canonical SMILES
C1=CC=C(C=C1)C(=O)CCC(=O)CCC(=O)O
0 references
Identifiers
InChI
InChI=1S/C13H14O4/c14-11(7-9-13(16)17)6-8-12(15)10-4-2-1-3-5-10/h1-5H,6-9H2,(H,16,17)
0 references
InChIKey
DCNLNHPQCXZOHD-UHFFFAOYSA-N
0 references
CAS Registry Number
6336-53-4
1 reference
InChIKey
DCNLNHPQCXZOHD-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
8 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=6336-53-4
PubChem CID
80634
0 references
UniChem compound ID
959511
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10212753
1 reference
matched by identifier from
InChIKey
InChIKey
DCNLNHPQCXZOHD-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID40135244
0 references
NSC number
39534
0 references
UNII
PUH46C48B9
1 reference
matched by identifier from
InChIKey
InChIKey
DCNLNHPQCXZOHD-UHFFFAOYSA-N
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