Ethyl cycloheptanecarboxylate
TL;DR: Ethyl cycloheptanecarboxylate (CAS 32777-26-7) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl cycloheptanecarboxylate
Also Known As: Ethyl cycloheptanecarboxylate, ethyl cycloheptane carboxylate, Cycloheptanecarboxylic acid ethyl ester, Ethylcycloheptanecarboxylate, Cycloheptanecarboxylic acid, ethyl ester
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 135.0 |
Chemical Identifiers
| CAS Number | 32777-26-7 |
|---|---|
| SMILES | CCOC(=O)C1CCCCCC1 |
| InChIKey | ADVNPUHITOJNRW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl cycloheptanecarboxylate (CAS 32777-26-7), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: ethyl cycloheptanecarboxylate.
Chemical Property Profile of Ethyl cycloheptanecarboxylate
Property Insights of Ethyl cycloheptanecarboxylate
The XLogP value of 3.1 indicates that Ethyl cycloheptanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl cycloheptanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl cycloheptanecarboxylate 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 Ethyl cycloheptanecarboxylate?
The CAS number of Ethyl cycloheptanecarboxylate is 32777-26-7.
What is the molecular formula of Ethyl cycloheptanecarboxylate?
The molecular formula of Ethyl cycloheptanecarboxylate is C10H18O2.
What is the molecular weight of Ethyl cycloheptanecarboxylate?
The molecular weight of Ethyl cycloheptanecarboxylate is 170.13 g/mol.
Where can I buy Ethyl cycloheptanecarboxylate?
You can request a quote for Ethyl cycloheptanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl cycloheptanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl cycloheptanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.