6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one
TL;DR: 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one (CAS 17429-55-9) is a chemical compound with molecular formula C14H18O2 and molecular weight 218.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one
Also Known As: 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one, Cyclohexanone, 6-furfurylidene-2,2,3-trimethyl-, 6-[(furan-2-yl)methylidene]-2,2,3-trimethylcyclohexan-1-one
| Molecular Formula | C14H18O2 |
|---|---|
| Molecular Weight | 218.13 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 30.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.13068 |
| Heavy Atoms | 16 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 17429-55-9 |
|---|---|
| SMILES | CC1CCC(=CC2=CC=CO2)C(=O)C1(C)C |
| InChIKey | GNXZHCBRQQQSFL-UHFFFAOYSA-N |
Product Overview
6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one (CAS 17429-55-9), with molecular formula C14H18O2 and molecular weight 218.13 g/mol. IUPAC: 6-(furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one.
Chemical Property Profile of 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one
Property Insights of 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one
The XLogP value of 3.5 indicates that 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.2 Ų, 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one 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 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one?
The CAS number of 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one is 17429-55-9.
What is the molecular formula of 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one?
The molecular formula of 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one is C14H18O2.
What is the molecular weight of 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one?
The molecular weight of 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one is 218.13 g/mol.
Where can I buy 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one?
You can request a quote for 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 6-(Furan-2-ylmethylidene)-2,2,3-trimethylcyclohexan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.