Basic information
- CAS
32953-65-4- Standard SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)OCCCCCCCC- InChIKey
QTDSLDJPJJBBLE-PFONDFGASA-N- Molecular formula
- C26H50O2
- Average molar mass
- 394.7 g/mol
- Monoisotopic mass
- 394.38108083
Names & identifiers
- Preferred name
- 9-Octadecenoic acid (9Z)-, octyl ester
- IUPAC
- octyl (Z)-octadec-9-enoate
- English name
- octyl oleate
- Molecular formula
- C26H50O2
- Molecular weight
- 394.67
Names & synonyms
32953-65-49-Octadecenoic acid (9Z)-, octyl esterEINECS 251-304-7DTXSID8067733RefChem:549629Octyl (9Z)-9-octadecenoateDTXCID001324241Octyl oleateOctyl cis-9-OctadecenoateOleic Acid Octyl Ester; Octyl (Z)-9-Octadecenoate; Octyl Oleate; Splender R 400;n-Octyl OleateOCTYL (9Z)-OCTADEC-9-ENOATESCHEMBL333643
Show more names
OLEICACID,OCTYLESTER9-Octadecenoic acid (Z)-, octyl ester
QTDSLDJPJJBBLE-PFONDFGASA-NNSC152070NSC-152070NS00020639
Database identifiers
- CAS
32953-65-4- PubChem CID
- 6436729
- DTXSID
DTXSID8067733- EC Number
- 251-304-7
- Nikkaji
- J319.479E
Properties
Computed structural properties
- XLogP
- 11
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 23
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 335
Experimental & physicochemical properties
Physical DescriptionLiquid
Physicochemical properties
- Melting point
- -9.3 °C · -9.3 °C
- Boiling point
- 469.242 · 469.242±24.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.868 · 0.868±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- solubility
- Dichloromethane; Ethyl Acetate; Methanol
- form
- Oil
- color
- Yellow
- LogP
- 11.88 · 11.880 (est)
- EPA Substance Registry System
- 9 · 9-Octadecenoic acid (9Z)-, octyl ester (32953-65-4)
- TSCA
- TSCA listed
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-Octadecenoic acid (9Z)-, octyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 9-Octadecenoic acid (9Z)-, octyl ester 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)
9-Octadecenoic acid (9Z)-, octyl ester: Does not have an individual approval but may be used under an appropriate group standard
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 75,000 - <500,000 lb
Industry UsesNot Known or Reasonably Ascertainable
General Manufacturing Information
Not Known or Reasonably Ascertainable
9-Octadecenoic acid (9Z)-, octyl ester: ACTIVE
Applications
UsesOctyl cis-9-Octadecenoate is an intermediate in synthesizing Octyl 3-Octyloxiraneoctanoic Acid (O292500). A compound useful in organic synthesis.
Suppliers2 total
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
BOC Sciences[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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