(3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one
TL;DR: (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one (CAS 129647-34-3) is a chemical compound with molecular formula C11H18O and molecular weight 166.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
cis-(3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one
Also Known As: (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one, Cyclohexanone, 3-methyl-2-methylene-6-(1-methylethyl)-, (3R,6R)- (9CI)
Technical Specifications
| Molecular Formula | C11H18O |
| Molecular Weight | 166.13577 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 166.13577 Da |
| Heavy Atoms | 12 |
| Complexity | 203.0 |
| SMILES | C[C@@H]1CC[C@@H](C(=O)C1=C)C(C)C |
| InChIKey | IRMRWAWQVBGNMC-PSASIEDQSA-N |
Chemical Property Profile of (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one
Property Insights of (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one
The XLogP value of 3.2 indicates that (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one 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
What is the CAS number of (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one?
The CAS number of (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one is 129647-34-3.
What is the molecular formula of (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one?
The molecular formula of (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one is C11H18O.
What is the molecular weight of (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one?
The molecular weight of (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one is 166.13577 g/mol.
Where can I buy (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one?
You can request a quote for (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one?
Yes, CoreyChem provides custom synthesis services for (3R,6R)-3-methyl-2-methylidene-6-propan-2-ylcyclohexan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.