![(1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one structure](/static/products/953/953414-33-0.png)
(1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one
TL;DR: (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one (CAS 953414-33-0) is a chemical compound with molecular formula C9H14O and molecular weight 138.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one
Also Known As: (1R,5R)-6,6-Dimethylbicyclo[3.1.1]heptan-2-one, (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-4-one, (1R,5S)-6,6-dimethylbicyclo[3.1.1]heptan-4-one
| Molecular Formula | C9H14O |
|---|---|
| Molecular Weight | 138.10 g/mol |
| LogP | 2.0116 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 138.10446 |
| Heavy Atoms | 10 |
| Complexity | 179.16728 |
Chemical Identifiers
| CAS Number | 953414-33-0 |
|---|---|
| SMILES | CC1([C@@H]2CCC(=O)[C@@H]1C2)C |
Product Overview
(1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one (CAS 953414-33-0), with molecular formula C9H14O and molecular weight 138.10 g/mol. IUPAC: (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one.
Chemical Property Profile of (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one
Property Insights of (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one
The XLogP value of 2.0116 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one. With a topological polar surface area (TPSA) of 17.07 Ų, (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-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
Frequently Asked Questions
What is the CAS number of (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one?
The CAS number of (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one is 953414-33-0.
What is the molecular formula of (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one?
The molecular formula of (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one is C9H14O.
What is the molecular weight of (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one?
The molecular weight of (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one is 138.10 g/mol.
Where can I buy (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one?
You can request a quote for (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one?
Yes, KEHONG BIO provides custom synthesis services for (1R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.