Products for Research Use Only

Octyl caprate

CAT: 0013-GTR19193261-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19193261-02Size:50 mg
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Description
Octyl caprate is a synthetic fatty acid ester used as a biochemical tool in research. It serves as a permeation enhancer in drug delivery studies and as a solvent or vehicle in both in vitro and in vivo experimental models.
CAS Number
2306-92-5
Smiles
O=C (OCCCCCCCC) CCCCCCCCC
Molecular Formula
C18H36O2
Molecular Weight
284.48
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Octyl caprate

Octyl decanoate is a carboxylic ester.

CAS Number2306-92-5
PubChem CID75321
IUPAC Nameoctyl decanoate
Molecular FormulaC18H36O2
Molecular Weight284.5
XLogP7.6
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count16
Heavy Atom Count20
Formal Charge0
Complexity202
SMILES
CCCCCCCCCC(=O)OCCCCCCCC
InChI
InChI=1S/C18H36O2/c1-3-5-7-9-11-12-14-16-18(19)20-17-15-13-10-8-6-4-2/h3-17H2,1-2H3
InChIKey
HRPZGPXWSVHWPB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Octyl caprate
CAS: 2306-92-5
CID: 75321
Formula: C18H36O2
MW: 284.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight284.5
XLogP37.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count16
Exact Mass284.271530387
Monoisotopic Mass284.271530387
Topological Polar Surface Area26.3 Ų
Heavy Atom Count20
Formal Charge0
Complexity202
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes