Undecyl hexanoate
Basic information
- CAS
103677-76-5- Standard SMILES
CCCCCCCCCCCOC(=O)CCCCC- InChIKey
PCUSXIRIPAHAHT-UHFFFAOYSA-N- Molecular formula
- C17H34O2
- Average molar mass
- 270.5 g/mol
- Monoisotopic mass
- 270.25588032
Names & identifiers
- Preferred name
- Undecyl hexanoate
- IUPAC
- undecyl hexanoate
Names & synonyms
Undecyl hexanoateHexanoic acid, undecyl ester103677-76-5DTXSID60341825RefChem:386920DTXCID20292905PCUSXIRIPAHAHT-UHFFFAOYSA-NUndecyl hexanoate #SCHEMBL3396314
Database identifiers
- CAS
103677-76-5- PubChem CID
- 576019
- DTXSID
DTXSID60341825
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 15
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 190
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…