3-Chloro-1,1,5-trimethylcyclohexane
TL;DR: 3-Chloro-1,1,5-trimethylcyclohexane (CAS 6967-43-7) is a chemical compound with molecular formula C9H17Cl and molecular weight 160.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-1,1,5-trimethylcyclohexane
Also Known As: 3-chloro-1,1,5-trimethylcyclohexane, CYCLOHEXANE,3-CHLORO-1,1,5-TRIMETHYL-
| Molecular Formula | C9H17Cl |
|---|---|
| Molecular Weight | 160.10 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 160.10188 |
| Heavy Atoms | 10 |
| Complexity | 118.0 |
Chemical Identifiers
| CAS Number | 6967-43-7 |
|---|---|
| SMILES | CC1CC(CC(C1)(C)C)Cl |
| InChIKey | JPSRVBMFEBRDCK-UHFFFAOYSA-N |
Product Overview
3-Chloro-1,1,5-trimethylcyclohexane (CAS 6967-43-7), with molecular formula C9H17Cl and molecular weight 160.10 g/mol. IUPAC: 3-chloro-1,1,5-trimethylcyclohexane.
Chemical Property Profile of 3-Chloro-1,1,5-trimethylcyclohexane
Property Insights of 3-Chloro-1,1,5-trimethylcyclohexane
The XLogP value of 3.9 indicates that 3-Chloro-1,1,5-trimethylcyclohexane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Chloro-1,1,5-trimethylcyclohexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-1,1,5-trimethylcyclohexane has 0 hydrogen bond donor(s) and 0 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 3-Chloro-1,1,5-trimethylcyclohexane?
The CAS number of 3-Chloro-1,1,5-trimethylcyclohexane is 6967-43-7.
What is the molecular formula of 3-Chloro-1,1,5-trimethylcyclohexane?
The molecular formula of 3-Chloro-1,1,5-trimethylcyclohexane is C9H17Cl.
What is the molecular weight of 3-Chloro-1,1,5-trimethylcyclohexane?
The molecular weight of 3-Chloro-1,1,5-trimethylcyclohexane is 160.10 g/mol.
Where can I buy 3-Chloro-1,1,5-trimethylcyclohexane?
You can request a quote for 3-Chloro-1,1,5-trimethylcyclohexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-1,1,5-trimethylcyclohexane?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-1,1,5-trimethylcyclohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.