Basic information
- CAS
109-39-7- Standard SMILES
CCCCCCCCC=CCCCCCCCC(=O)OCCOCCCC- InChIKey
LBUOSVPOVIEPLJ-UHFFFAOYSA-N- Molecular formula
- C24H46O3
- Average molar mass
- 382.6 g/mol
- Monoisotopic mass
- 382.34469533
Overview
2-butoxyethyl octadec-9-enoate has been reported in Bidens pilosa with data available.
Names & identifiers
- Preferred name
- 2-Butoxyethyl octadec-9-enoate
- IUPAC
- 2-butoxyethyl octadec-9-enoate
- English name
- 2-Butoxyethyl oleate
- Molecular formula
- C24H46O3
- Molecular weight
- 382.62
Names & synonyms
2-butoxyethyl octadec-9-enoateSCHEMBL9174462-BUTOXYETHYL CIS-OCTADEC-9-ENOATENS000235212-butoxyethylester2-Butoxyethyl oleate2-BUTOXYETHYL OLEATE, TECH.Ethyleneglycol monobutyl ether oleate(Z)-9-Octadecenoic acid 2-butoxyethyl ester9-Octadecenoic acid (9Z)-, 2-butoxyethyl ester
Database identifiers
- CAS
109-39-7- PubChem CID
- 66959
- DTXSID
DTXSID0059370
Properties
Computed structural properties
- XLogP
- 8.7
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 22
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 326
Physicochemical properties
- Boiling point
- 462.5 · 462.5±28.0 °C(Predicted)
- Density
- 0.89 g/mL · 0.89 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.455(lit.)
- Flash point
- 113 °C · 113 °C
- CAS DataBase Reference
- 109 · 109-39-7
- FDA UNII
- 401 N7O67AA · 401N7O67AA
- EPA Substance Registry System
- 9 · 9-Octadecenoic acid (9Z)-, 2-butoxyethyl ester (109-39-7)
- 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.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Applications
UsesPlasticizer.
Suppliers4 total
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
西安莱茵生物科技有限公司86-(0)29-85992781 17792393971 · [email protected]
Novachemistry44-20819178-90 02081917890 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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