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| SKU | Size | Availability |
Price | Qty |
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I434325-1ml
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1ml |
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
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$145.90
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| Synonyms | AS-10358 | EINECS 256-557-7 | Isopulegol | (1R,3R,4S)-P-METH-8-EN-3-OL | 5-Methyl-2-(1-methylethenyl)cyclohexanol, (1R-(1alpha,2beta,5alpha))- | GTPL2462 | NVG8YK55NL | p-8(9)-Menthen-3-ol | Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1R,2S,5R)- | DTXSI |
|---|---|
| Specifications & Purity | Moligand™, ≥99% |
| Grade | Moligand™ |
| Product Description |
Isopulegol is monoterpene alcohol, a useful ingredient for the production of fragrances in perfume industries. It is also used as a starting material in the manufacture of menthol by the hydrogenation process. Menthol is an important component in cosmetics, pharmaceuticals, and toothpaste. Application (−)-Isopulegol can be used as a starting material for the enantioselective preparation of: 8-arylmenthols by Smiles-Truce rearrangement of aryl sulfonates.,· Stereoisomers of 5,9-dimethylpentadecane. Octahydro-2 H -chromen-4-ol by Prins cyclization with vanillin in the presence of montmorillonite clay as the catalyst. p -menthane-3,8,9-triol by catalytic Sharpless dihydroxylation. |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Lipids and lipid-like molecules |
| Class | Prenol lipids |
| Subclass | Monoterpenoids |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Menthane monoterpenoids |
| Alternative Parents | Monocyclic monoterpenoids Cyclohexanols Cyclic alcohols and derivatives Hydrocarbon derivatives |
| Molecular Framework | Aliphatic homomonocyclic compounds |
| Substituents | P-menthane monoterpenoid - Monocyclic monoterpenoid - Cyclohexanol - Cyclic alcohol - Secondary alcohol - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as menthane monoterpenoids. These are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. |
| External Descriptors | p-menthane monoterpenoid |
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| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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| IUPAC Name | (1R,2S,5R)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-ol |
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| INCHI | InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h8-11H,1,4-6H2,2-3H3/t8-,9+,10-/m1/s1 |
| InChIKey | ZYTMANIQRDEHIO-KXUCPTDWSA-N |
| Smiles | CC1CCC(C(C1)O)C(=C)C |
| Isomeric SMILES | C[C@@H]1CC[C@H]([C@@H](C1)O)C(=C)C |
| Alternate CAS | 89-79-2,50373-36-9,59905-53-2,7786-67-6 |
| NSC Number | 1263 |
| MeSH Entry Terms | isopulegol |
| Molecular Weight | 154.25 |
| Reaxy-Rn | 4128962 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4128962&ln= |
| Molecular Weight | 154.250 g/mol |
|---|---|
| XLogP3 | 3.000 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 154.136 Da |
| Monoisotopic Mass | 154.136 Da |
| Topological Polar Surface Area | 20.200 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 151.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |