4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)-
TL;DR: 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)- (CAS 55162-84-0) is a chemical compound with molecular formula C9H16O3 and molecular weight 172.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-5-ethoxypent-4-enoate
Also Known As: ethyl (E)-5-ethoxypent-4-enoate, Ethyl (4E)-5-ethoxy-4-pentenoate, ethyl (4E)-5-ethoxypent-4-enoate, Ethyl (4E)-5-ethoxy-4-pentenoate #, (E)-5-Ethoxy-4-pentenoic acid ethyl ester
| Molecular Formula | C9H16O3 |
|---|---|
| Molecular Weight | 172.11 g/mol |
| LogP | 1.8799 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 172.10994 |
| Heavy Atoms | 12 |
| Complexity | 140.70908 |
Chemical Identifiers
| CAS Number | 55162-84-0 |
|---|---|
| SMILES | CCO/C=C/CCC(=O)OCC |
Product Overview
4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)- (CAS 55162-84-0), with molecular formula C9H16O3 and molecular weight 172.11 g/mol. IUPAC: ethyl (E)-5-ethoxypent-4-enoate.
Chemical Property Profile of 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)-
Property Insights of 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)-
The XLogP value of 1.8799 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)-. With a topological polar surface area (TPSA) of 35.53 Ų, 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)- 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 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)-?
The CAS number of 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)- is 55162-84-0.
What is the molecular formula of 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)-?
The molecular formula of 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)- is C9H16O3.
What is the molecular weight of 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)-?
The molecular weight of 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)- is 172.11 g/mol.
Where can I buy 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)-?
You can request a quote for 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)-?
Yes, KEHONG BIO provides custom synthesis services for 4-Pentenoic acid, 5-ethoxy-, ethyl ester, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.