cis-2,5-Dimethylcyclopentanone
TL;DR: cis-2,5-Dimethylcyclopentanone (CAS 6672-39-5) is a chemical compound with molecular formula C7H12O and molecular weight 112.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cis-(2S,5R)-2,5-dimethylcyclopentan-1-one
Also Known As: cis-2,5-dimethylcyclopentanone, cis-2,5-Dimethylcyclopentanon, Cyclopentanone, 2,5-dimethyl-, cis-, 2alpha,5alpha-Dimethylcyclopentanone, (2R,5S)-2,5-dimethylcyclopentanone
| Molecular Formula | C7H12O |
|---|---|
| Molecular Weight | 112.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 112.08881 |
| Heavy Atoms | 8 |
| Complexity | 95.0 |
Chemical Identifiers
| CAS Number | 6672-39-5 |
|---|---|
| SMILES | C[C@@H]1CC[C@@H](C1=O)C |
| InChIKey | MKLARKDYEBNZFK-OLQVQODUSA-N |
Product Overview
cis-2,5-Dimethylcyclopentanone (CAS 6672-39-5), with molecular formula C7H12O and molecular weight 112.09 g/mol. IUPAC: cis-(2S,5R)-2,5-dimethylcyclopentan-1-one.
Chemical Property Profile of cis-2,5-Dimethylcyclopentanone
Property Insights of cis-2,5-Dimethylcyclopentanone
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-2,5-Dimethylcyclopentanone. With a topological polar surface area (TPSA) of 17.1 Ų, cis-2,5-Dimethylcyclopentanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-2,5-Dimethylcyclopentanone 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-2,5-Dimethylcyclopentanone?
The CAS number of cis-2,5-Dimethylcyclopentanone is 6672-39-5.
What is the molecular formula of cis-2,5-Dimethylcyclopentanone?
The molecular formula of cis-2,5-Dimethylcyclopentanone is C7H12O.
What is the molecular weight of cis-2,5-Dimethylcyclopentanone?
The molecular weight of cis-2,5-Dimethylcyclopentanone is 112.09 g/mol.
Where can I buy cis-2,5-Dimethylcyclopentanone?
You can request a quote for cis-2,5-Dimethylcyclopentanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-2,5-Dimethylcyclopentanone?
Yes, KEHONG BIO provides custom synthesis services for cis-2,5-Dimethylcyclopentanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.