(2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone
TL;DR: (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone (CAS 29606-79-9) 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.
trans-(2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-one
Also Known As: Isopulegone, Isopulegon, trans-Isopulegone, D-Isopulegone, (+)-Isopulegone
| Molecular Formula | C10H16O |
|---|---|
| Molecular Weight | 152.12 g/mol |
| LogP | 2.5678 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 152.12012 |
| Heavy Atoms | 11 |
| Complexity | 181.3118 |
Chemical Identifiers
| CAS Number | 29606-79-9 |
|---|---|
| SMILES | C[C@H]1CC[C@@H](C(=O)C1)C(=C)C |
Product Overview
(2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone (CAS 29606-79-9), with molecular formula C10H16O and molecular weight 152.12 g/mol. IUPAC: trans-(2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-one.
Chemical Property Profile of (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone
Property Insights of (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone
The XLogP value of 2.5678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone. With a topological polar surface area (TPSA) of 17.07 Ų, (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone 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 (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone?
The CAS number of (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone is 29606-79-9.
What is the molecular formula of (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone?
The molecular formula of (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone is C10H16O.
What is the molecular weight of (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone?
The molecular weight of (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone is 152.12 g/mol.
Where can I buy (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone?
You can request a quote for (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone?
Yes, KEHONG BIO provides custom synthesis services for (2R,5S)-5-Methyl-2-(1-methylethenyl)cyclohexanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.