(+)-cis-Isopulegone
TL;DR: (+)-cis-Isopulegone (CAS 3391-89-7) is a chemical compound with molecular formula C10H16O and molecular weight 152.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cis-(2R,5R)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-one
Also Known As: (+)-cis-Isopulegone, Regiomontanin, Isopulegone, (2R,5R)-isopulegone, (+)-(1r,4r)-cis-isopulegone
| Molecular Formula | C10H16O |
|---|---|
| Molecular Weight | 152.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 152.12012 |
| Heavy Atoms | 11 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 3391-89-7 |
|---|---|
| SMILES | C[C@@H]1CC[C@@H](C(=O)C1)C(=C)C |
| InChIKey | RMIANEGNSBUGDJ-RKDXNWHRSA-N |
Product Overview
(+)-cis-Isopulegone (CAS 3391-89-7), with molecular formula C10H16O and molecular weight 152.12 g/mol. IUPAC: cis-(2R,5R)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-one.
Chemical Property Profile of (+)-cis-Isopulegone
Property Insights of (+)-cis-Isopulegone
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (+)-cis-Isopulegone. With a topological polar surface area (TPSA) of 17.1 Ų, (+)-cis-Isopulegone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+)-cis-Isopulegone has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (+)-cis-Isopulegone?
The CAS number of (+)-cis-Isopulegone is 3391-89-7.
What is the molecular formula of (+)-cis-Isopulegone?
The molecular formula of (+)-cis-Isopulegone is C10H16O.
What is the molecular weight of (+)-cis-Isopulegone?
The molecular weight of (+)-cis-Isopulegone is 152.12 g/mol.
Where can I buy (+)-cis-Isopulegone?
You can request a quote for (+)-cis-Isopulegone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+)-cis-Isopulegone?
Yes, KEHONG BIO provides custom synthesis services for (+)-cis-Isopulegone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.