Butyl 3-ethoxypropanoate
TL;DR: Butyl 3-ethoxypropanoate (CAS 14144-35-5) is a chemical compound with molecular formula C9H18O3 and molecular weight 174.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 3-ethoxypropanoate
Also Known As: butyl 3-ethoxypropanoate, 3-ethoxy-propanoic acid butyl ester, 3-ethoxypropionic acid butyl ester, Propanoic acid,3-ethoxy-, butyl ester
| Molecular Formula | C9H18O3 |
|---|---|
| Molecular Weight | 174.13 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 174.1256 |
| Heavy Atoms | 12 |
| Complexity | 112.0 |
Chemical Identifiers
| CAS Number | 14144-35-5 |
|---|---|
| SMILES | CCCCOC(=O)CCOCC |
| InChIKey | MVWVAXBILFBQIZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyl 3-ethoxypropanoate (CAS 14144-35-5), with molecular formula C9H18O3 and molecular weight 174.13 g/mol. IUPAC: butyl 3-ethoxypropanoate.
Chemical Property Profile of Butyl 3-ethoxypropanoate
Property Insights of Butyl 3-ethoxypropanoate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl 3-ethoxypropanoate. With a topological polar surface area (TPSA) of 35.5 Ų, Butyl 3-ethoxypropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl 3-ethoxypropanoate has 0 hydrogen bond donor(s) and 3 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 Butyl 3-ethoxypropanoate?
The CAS number of Butyl 3-ethoxypropanoate is 14144-35-5.
What is the molecular formula of Butyl 3-ethoxypropanoate?
The molecular formula of Butyl 3-ethoxypropanoate is C9H18O3.
What is the molecular weight of Butyl 3-ethoxypropanoate?
The molecular weight of Butyl 3-ethoxypropanoate is 174.13 g/mol.
Where can I buy Butyl 3-ethoxypropanoate?
You can request a quote for Butyl 3-ethoxypropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 3-ethoxypropanoate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 3-ethoxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.