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(Q81990652)
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English
Decanedioic acid, dinonyl ester
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
454.727
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₅₄O₄
0 references
canonical SMILES
CCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCCCCC
0 references
Identifiers
InChI
InChI=1S/C28H54O4/c1-3-5-7-9-13-17-21-25-31-27(29)23-19-15-11-12-16-20-24-28(30)32-26-22-18-14-10-8-6-4-2/h3-26H2,1-2H3
0 references
InChIKey
VNTXONBESJNLBI-UHFFFAOYSA-N
0 references
CAS Registry Number
4121-16-8
1 reference
InChIKey
VNTXONBESJNLBI-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=4121-16-8
PubChem CID
20075
1 reference
matched by identifier from
InChIKey
InChIKey
VNTXONBESJNLBI-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL502644
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VNTXONBESJNLBI-UHFFFAOYSA-N
UniChem compound ID
23399191
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID0063313
1 reference
matched by identifier from
InChIKey
InChIKey
VNTXONBESJNLBI-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID7039880
0 references
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