2-Cyclohexen-1-one, triethyltrimethyl-
TL;DR: 2-Cyclohexen-1-one, triethyltrimethyl- (CAS 68845-35-2) is a chemical compound with molecular formula C15H26O and molecular weight 222.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,4-triethyl-2,5,5-trimethylcyclohex-2-en-1-one
Also Known As: Triethyltrimethyl-2-cyclohexenone, 2-Cyclohexen-1-one, triethyltrimethyl-, Triethyltrimethylcyclohex-2-en-1-one, 3,4,4-triethyl-2,5,5-trimethylcyclohex-2-en-1-one, EINECS 272-461-8
| Molecular Formula | C15H26O |
|---|---|
| Molecular Weight | 222.20 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.19836 |
| Heavy Atoms | 16 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 68845-35-2 |
|---|---|
| SMILES | CCC1=C(C(=O)CC(C1(CC)CC)(C)C)C |
| InChIKey | BUWKKTZEUORNQO-UHFFFAOYSA-N |
Product Overview
2-Cyclohexen-1-one, triethyltrimethyl- (CAS 68845-35-2), with molecular formula C15H26O and molecular weight 222.20 g/mol. IUPAC: 3,4,4-triethyl-2,5,5-trimethylcyclohex-2-en-1-one.
Chemical Property Profile of 2-Cyclohexen-1-one, triethyltrimethyl-
Property Insights of 2-Cyclohexen-1-one, triethyltrimethyl-
The XLogP value of 4.4 indicates that 2-Cyclohexen-1-one, triethyltrimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Cyclohexen-1-one, triethyltrimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Cyclohexen-1-one, triethyltrimethyl- 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 2-Cyclohexen-1-one, triethyltrimethyl-?
The CAS number of 2-Cyclohexen-1-one, triethyltrimethyl- is 68845-35-2.
What is the molecular formula of 2-Cyclohexen-1-one, triethyltrimethyl-?
The molecular formula of 2-Cyclohexen-1-one, triethyltrimethyl- is C15H26O.
What is the molecular weight of 2-Cyclohexen-1-one, triethyltrimethyl-?
The molecular weight of 2-Cyclohexen-1-one, triethyltrimethyl- is 222.20 g/mol.
Where can I buy 2-Cyclohexen-1-one, triethyltrimethyl-?
You can request a quote for 2-Cyclohexen-1-one, triethyltrimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyclohexen-1-one, triethyltrimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyclohexen-1-one, triethyltrimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.