Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate
TL;DR: Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate (CAS 135984-50-8) is a chemical compound with molecular formula C14H22O4 and molecular weight 254.15181 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate
Also Known As: methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-dienecarboxylate, methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate
Technical Specifications
| Molecular Formula | C14H22O4 |
| Molecular Weight | 254.15181 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 254.15181 Da |
| Heavy Atoms | 18 |
| Complexity | 346.0 |
| SMILES | CCC1C(=CC(C=C1OC)(CC)C(=O)OC)OC |
| InChIKey | LAIWPLIQZVAVEB-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate
Property Insights of Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate. With a topological polar surface area (TPSA) of 44.8 Ų, Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate 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
What is the CAS number of Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate?
The CAS number of Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate is 135984-50-8.
What is the molecular formula of Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate?
The molecular formula of Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate is C14H22O4.
What is the molecular weight of Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate?
The molecular weight of Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate is 254.15181 g/mol.
Where can I buy Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate?
You can request a quote for Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 1,4-diethyl-3,5-dimethoxycyclohexa-2,5-diene-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.