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Linalool oxide (Standard)

CAT: 0804-HY-N9502R-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N9502R-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Linalool oxide (Standard) is the analytical standard of Linalool oxide. This product is intended for research and analytical applications. Linalool oxide is a secondary metabolite in elongating wheat plants with antinociceptive and anticonvulsant effects. Linalool oxide shows anxiolytic activity[1][2][3].
CAS Number
60047-17-8
UNSPSC
12352005
Target
Others; Reference Standards
Related Pathways
Others
Field of Research
Neurological Disease
Smiles
C=CC(OC1C(C)(O)C)(CC1)C
Molecular Formula
C10H18O2
Molecular Weight
170.25
References & Citations
[1]Souto-Maior FN, et al. Antinociceptive and anticonvulsant effects of the monoterpene linalool oxide. Pharm Biol. 2017 Dec;55 (1) :63-67. |[2]Souto-Maior FN, et al. Anxiolytic-like effects of inhaled linalool oxide in experimental mouse anxiety models. Pharmacol Biochem Behav. 2011 Dec;100 (2) :259-63. |[3]Piesik D, et al. Mechanically-injured wheat plants release greater amounts of the secondary metabolites linalool and linalool oxide[J]. Journal of Plant Protection Research, 2006: 29-39-29-39.
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

Linalool, oxide

Linalyl oxide is a member of oxolanes.

CAS Number60047-17-8
PubChem CID22310
IUPAC Name2-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol
Molecular FormulaC10H18O2
Molecular Weight170.25
XLogP1.4
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity186
SMILES
CC1(CCC(O1)C(C)(C)O)C=C
InChI
InChI=1S/C10H18O2/c1-5-10(4)7-6-8(12-10)9(2,3)11/h5,8,11H,1,6-7H2,2-4H3
InChIKey
BRHDDEIRQPDPMG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Linalool, oxide
CAS: 60047-17-8
CID: 22310
Formula: C10H18O2
MW: 170.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight170.25
XLogP31.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass170.130679813
Monoisotopic Mass170.130679813
Topological Polar Surface Area29.5 Ų
Heavy Atom Count12
Formal Charge0
Complexity186
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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