MetaADEDB 2.0 @ LMMD
diisononyl phthalate
(HBGGXOJOCNVPFY-UHFFFAOYSA-N)
Structure
SMILES
CC(CCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCC(C)C)C
Molecular Formula:
C26H42O4
Molecular Weight:
418.609
Log P:
7.2132
Hydrogen Bond Acceptor:
4
Hydrogen Bond Donor:
0
TPSA:
52.6
CAS Number(s):
20548-62-3; 28553-12-0; 68515-48-0
Synonym(s)
1.
diisononyl phthalate
2.
ENJ 2065
3.
ENJ-2065
4.
di-isononylphthalate
External Link(s)
MeSHC012125
PubChem Compound590836
ChEBI35459
CHEMBLCHEMBL1905899
KEGGcpd:C15221
ZINC4538442
Adverse Drug Event(s)
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