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Citronellyl acetate (Standard)

CAT: 0804-HY-N7144AR-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N7144AR-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Citronellyl acetate (Standard) is the analytical standard of Citronellyl acetate. This product is intended for research and analytical applications. Citronellyl acetate is a monoterpene product of the secondary metabolism of plants, with antinociceptive activity. Citronellyl acetate exhibits pro-apoptotic activity in human hepatoma cells. Citronellyl acetate shows fungicidal, larvicidal, bactericidal and repelling/insecticidal effects[1].
CAS Number
150-84-5
UNSPSC
12352211
Target
Apoptosis; Reference Standards
Type
Reference Standards
Related Pathways
Apoptosis; Others
Field of Research
Cancer; Infection
Assay Protocol
https://www.medchemexpress.com/citronellyl-acetate-standard.html
Smiles
C/C(C)=C\CCC(C)CCOC(C)=O
Molecular Formula
C12H22O2
Molecular Weight
198.30
References & Citations
[1]Rios ER, et al. TRP and ASIC channels mediate the antinociceptive effect of citronellyl acetate. Chem Biol Interact. 2013 May 25;203 (3) :573-9.
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

Citronellyl Acetate

Citronellol acetate is a monoterpenoid that is the acetate ester of citronellol. It has been isolated from Citrus hystrix. It has a role as a plant metabolite. It is a monoterpenoid and an acetate ester. It is functionally related to a citronellol.

CAS Number150-84-5
PubChem CID9017
IUPAC Name3,7-dimethyloct-6-enyl acetate
Molecular FormulaC12H22O2
Molecular Weight198.30
XLogP3.8
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count7
Heavy Atom Count14
Formal Charge0
Complexity190
SMILES
CC(CCC=C(C)C)CCOC(=O)C
InChI
InChI=1S/C12H22O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,11H,5,7-9H2,1-4H3
InChIKey
JOZKFWLRHCDGJA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Citronellyl Acetate
CAS: 150-84-5
CID: 9017
Formula: C12H22O2
MW: 198.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight198.30
XLogP33.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count7
Exact Mass198.161979940
Monoisotopic Mass198.161979940
Topological Polar Surface Area26.3 Ų
Heavy Atom Count14
Formal Charge0
Complexity190
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
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