MetaADEDB 2.0 @ LMMD
pelargonic acid
(FBUKVWPVBMHYJY-UHFFFAOYSA-N)
Structure
SMILES
CCCCCCCCC(=O)O
Molecular Formula:
C9H18O2
Molecular Weight:
158.238
Log P:
2.8216
Hydrogen Bond Acceptor:
2
Hydrogen Bond Donor:
1
TPSA:
37.3
CAS Number(s):
112-05-0; 68937-75-7
Synonym(s)
1.
pelargonic acid
2.
nonanoic acid
3.
pelargonic acid, aluminum salt
4.
pelargonic acid, cadmium salt
5.
pelargonic acid, calcium salt
6.
pelargonic acid, potassium salt
7.
pelargonic acid, sodium salt
8.
pelargonic acid, zinc salt
9.
potassium nonanoate
External Link(s)
MeSHC008776
PubChem Compound8158
ChEBI29019
CHEMBLCHEMBL108436
KEGGcpd:C01601
ZINC1529234
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Poisoning23391484CTD
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