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Capryl caprate

CAT: 0013-GTR19201842Size: 1 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19201842Size:1 g
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Description
Capryl caprate, also known as decyl decanoate, is a compound isolated from the tergite glands of virgin queen honey bees (Apis mellifera) . This ester is of interest in chemical ecology research for studying pheromone communication and can be utilized in both in vitro assays and in vivo behavioral experiments with insects.
CAS Number
1654-86-0
Product Name Alternative
Capryl caprate, Decanoic acid, decyl ester, Decanoic acid decyl ester, Decyl decanoate
Purity
98.46% (May vary between batches)
Solubility
DMSO:1 mg/mL (3.2 mM)
Smiles
CCCCCCCCCCOC (=O) CCCCCCCCC
Molecular Formula
C20H40O2
Molecular Weight
312.53
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Capryl caprate

Decyl decanoate is a carboxylic ester.

CAS Number1654-86-0
PubChem CID74247
IUPAC Namedecyl decanoate
Molecular FormulaC20H40O2
Molecular Weight312.5
XLogP8.7
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count18
Heavy Atom Count22
Formal Charge0
Complexity226
SMILES
CCCCCCCCCCOC(=O)CCCCCCCCC
InChI
InChI=1S/C20H40O2/c1-3-5-7-9-11-13-15-17-19-22-20(21)18-16-14-12-10-8-6-4-2/h3-19H2,1-2H3
InChIKey
XAKXZZPEUKNHMA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Capryl caprate
CAS: 1654-86-0
CID: 74247
Formula: C20H40O2
MW: 312.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight312.5
XLogP38.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count18
Exact Mass312.302830514
Monoisotopic Mass312.302830514
Topological Polar Surface Area26.3 Ų
Heavy Atom Count22
Formal Charge0
Complexity226
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

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