Octadeca-2,4-dienedioic acid
Basic information
- CAS
86490-43-9- Standard SMILES
O=C(O)C=CC=CCCCCCCCCCCCCC(=O)O- InChIKey
ZKQNWTGXRAIVGG-UHFFFAOYSA-N- Molecular formula
- C18H30O4
- Average molar mass
- 310.4 g/mol
- Monoisotopic mass
- 310.21440943
Names & identifiers
- Preferred name
- Octadeca-2,4-dienedioic acid
- IUPAC
- octadeca-2,4-dienedioic acid
Names & synonyms
OCTADECA-2,4-DIENEDIOIC ACIDDTXSID9071216086490-43-9RefChem:366652DTXCID60662906octadecadien-1,18-dioic acidSCHEMBL2552676
Database identifiers
- CAS
86490-43-9- PubChem CID
- 54552159
- DTXSID
DTXSID90712160
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 15
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 345
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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