Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate
TL;DR: Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate (CAS 85665-70-9) is a chemical compound with molecular formula C17H26O4 and molecular weight 294.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[2-(2,2,3-trimethylcyclopent-3-en-1-yl)ethylidene]propanedioate
Also Known As: diethyl[2- ethylidene]malonate, EINECS 288-161-5, Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate, diethyl 2-[2-(2,2,3-trimethylcyclopent-3-en-1-yl)ethylidene]propanedioate, DIETHYL [2-(2,2,3-TRIMETHYL-3-CYCLOPENTEN-1-YL)ETHYLIDENE]MALONATE
| Molecular Formula | C17H26O4 |
|---|---|
| Molecular Weight | 294.18 g/mol |
| LogP | 3.4215 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 294.1831 |
| Heavy Atoms | 21 |
| Complexity | 437.41055 |
Chemical Identifiers
| CAS Number | 85665-70-9 |
|---|---|
| SMILES | CCOC(=O)C(=CCC1CC=C(C1(C)C)C)C(=O)OCC |
Product Overview
Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate (CAS 85665-70-9), with molecular formula C17H26O4 and molecular weight 294.18 g/mol. IUPAC: diethyl 2-[2-(2,2,3-trimethylcyclopent-3-en-1-yl)ethylidene]propanedioate.
Chemical Property Profile of Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate
Property Insights of Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate
The XLogP value of 3.4215 indicates that Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate has 0 hydrogen bond donor(s) and 4 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 Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate?
The CAS number of Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate is 85665-70-9.
What is the molecular formula of Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate?
The molecular formula of Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate is C17H26O4.
What is the molecular weight of Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate?
The molecular weight of Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate is 294.18 g/mol.
Where can I buy Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate?
You can request a quote for Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl (2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene)malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.