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(±) -Isomenthone

CAT: 0804-HY-N7259B-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N7259B-01Size:5 mg
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Description
(±) -Isomenthone is a naturally active compound, a racemate of Isomenthone. (±) -Isomenthone has optical activity and is mainly used to measure the activity[1].
CAS Number
491-07-6
UNSPSC
12352211
Hazard Statement
H302
Target
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/racemic-isomenthone.html
Purity
86.29
Solubility
10 mM in DMSO
Smiles
CC([C@H]1C(C[C@H](CC1)C)=O)C
Molecular Formula
C10H18O
Molecular Weight
154.25
Precautions
H302
References & Citations
[1]Chaturvedi S, et al. Bioinoculant with Vermicompost Augments Essential Oil Constituents and Antioxidants in Mentha arvensis L[J]. Journal of Plant Growth Regulation, 2021, 40 (3) : 1284-1297.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

p-Menthan-3-one

P-menthan-3-one is a p-menthane monoterpenoid that is p-menthane substituted by an oxo group at position 3. It has a role as a volatile oil component and a plant metabolite.

CAS Number491-07-6
PubChem CID6986
IUPAC Name5-methyl-2-propan-2-ylcyclohexan-1-one
Molecular FormulaC10H18O
Molecular Weight154.25
XLogP2.7
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity149
SMILES
CC1CCC(C(=O)C1)C(C)C
InChI
InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3
InChIKey
NFLGAXVYCFJBMK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of p-Menthan-3-one
CAS: 491-07-6
CID: 6986
Formula: C10H18O
MW: 154.25
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight154.25
XLogP32.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass154.135765193
Monoisotopic Mass154.135765193
Topological Polar Surface Area17.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity149
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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