5-Hexylcyclohex-4-ene-1,3-dione
TL;DR: 5-Hexylcyclohex-4-ene-1,3-dione (CAS 6308-37-8) is a chemical compound with molecular formula C12H18O2 and molecular weight 194.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hexylcyclohex-4-ene-1,3-dione
Also Known As: 5-hexylcyclohex-4-ene-1,3-dione, 1,3-di(furan-2-yl)propane, 3-hexylcyclohex-2-ene-1,5-dione
| Molecular Formula | C12H18O2 |
|---|---|
| Molecular Weight | 194.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 194.13068 |
| Heavy Atoms | 14 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 6308-37-8 |
|---|---|
| SMILES | CCCCCCC1=CC(=O)CC(=O)C1 |
| InChIKey | OHOSERCMJSAKGW-UHFFFAOYSA-N |
Product Overview
5-Hexylcyclohex-4-ene-1,3-dione (CAS 6308-37-8), with molecular formula C12H18O2 and molecular weight 194.13 g/mol. IUPAC: 5-hexylcyclohex-4-ene-1,3-dione.
Chemical Property Profile of 5-Hexylcyclohex-4-ene-1,3-dione
Property Insights of 5-Hexylcyclohex-4-ene-1,3-dione
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Hexylcyclohex-4-ene-1,3-dione. With a topological polar surface area (TPSA) of 34.1 Ų, 5-Hexylcyclohex-4-ene-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Hexylcyclohex-4-ene-1,3-dione has 0 hydrogen bond donor(s) and 2 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 5-Hexylcyclohex-4-ene-1,3-dione?
The CAS number of 5-Hexylcyclohex-4-ene-1,3-dione is 6308-37-8.
What is the molecular formula of 5-Hexylcyclohex-4-ene-1,3-dione?
The molecular formula of 5-Hexylcyclohex-4-ene-1,3-dione is C12H18O2.
What is the molecular weight of 5-Hexylcyclohex-4-ene-1,3-dione?
The molecular weight of 5-Hexylcyclohex-4-ene-1,3-dione is 194.13 g/mol.
Where can I buy 5-Hexylcyclohex-4-ene-1,3-dione?
You can request a quote for 5-Hexylcyclohex-4-ene-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Hexylcyclohex-4-ene-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Hexylcyclohex-4-ene-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.