2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester
TL;DR: 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester (CAS 38701-10-9) is a chemical compound with molecular formula C16H20O2 and molecular weight 244.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-ethyl-4-phenylhexa-2,3-dienoate
Also Known As: ethyl 2-ethyl-4-phenylhexa-2,3-dienoate, Ethyl 2-ethyl-4-phenyl-2,3-hexadienoate, 2-Ethyl-4-phenyl-2,3-hexadienoicacidethylester, Ethyl 2-ethyl-4-phenyl-2,3-hexadienoate #, 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester
| Molecular Formula | C16H20O2 |
|---|---|
| Molecular Weight | 244.15 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 244.14633 |
| Heavy Atoms | 18 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 38701-10-9 |
|---|---|
| SMILES | CCC(=C=C(CC)C(=O)OCC)C1=CC=CC=C1 |
| InChIKey | FGUAEXKTKKXDAL-UHFFFAOYSA-N |
Product Overview
2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester (CAS 38701-10-9), with molecular formula C16H20O2 and molecular weight 244.15 g/mol. IUPAC: ethyl 2-ethyl-4-phenylhexa-2,3-dienoate.
Chemical Property Profile of 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester
Property Insights of 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester
The XLogP value of 4.0 indicates that 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester 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 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester?
The CAS number of 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester is 38701-10-9.
What is the molecular formula of 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester?
The molecular formula of 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester is C16H20O2.
What is the molecular weight of 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester?
The molecular weight of 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester is 244.15 g/mol.
Where can I buy 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester?
You can request a quote for 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Hexadienoic acid, 2-ethyl-4-phenyl-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.