9-Eicosenoic Acid
Basic information
- CAS
506-31-0- Standard SMILES
CCCCCCCCCCC=CCCCCCCCC(=O)O- InChIKey
LQJBNNIYVWPHFW-UHFFFAOYSA-N- Molecular formula
- C20H38O2
- Average molar mass
- 310.5 g/mol
- Monoisotopic mass
- 310.28718045
Overview
9-Eicosenoic acid has been reported in Punica granatum and Mangifera indica with data available.
Names & identifiers
- Preferred name
- 9-Eicosenoic Acid
- IUPAC
- icos-9-enoic acid
Names & synonyms
9-Eicosenoic acid506-31-0DTXSID6060135RefChem:1074966DTXCID2040860208-032-99-eicosaenoic acidEINECS 208-032-9SCHEMBL150979LQJBNNIYVWPHFW-UHFFFAOYSA-NEBA20402NS00019902
Database identifiers
- CAS
506-31-0- PubChem CID
- 94159
- DTXSID
DTXSID6060135- EC Number
- 208-032-9
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 17
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 258
Experimental & physicochemical properties
Physical DescriptionLiquid
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory Information
9-Eicosenoic acid is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 9-Eicosenoic acid are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
EPA Safer ChemicalChemical: 9-Eicosenoic acid
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 2,500,000 - <4,000,000 lb
Consumer UsesBinder
Industry UsesIntermediate
Use Classification
EPA Safer Chemical Functional Use Classes -> Surfactants
Safer Chemical Classes -> Green circle - The chemical has been verified to be of low concern
General Manufacturing Information
Miscellaneous Manufacturing
9-Eicosenoic acid: ACTIVE
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…