Ethyl 2-methyl-4-phenylhexa-2,3-dienoate
TL;DR: Ethyl 2-methyl-4-phenylhexa-2,3-dienoate (CAS 38701-07-4) is a chemical compound with molecular formula C15H18O2 and molecular weight 230.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methyl-4-phenylhexa-2,3-dienoate
Also Known As: ethyl 2-methyl-4-phenylhexa-2,3-dienoate, Ethyl 2-methyl-4-phenyl-2,3-hexadienoate, 2-Methyl-4-phenyl-2,3-hexadienoicacidethylester, Ethyl 2-methyl-4-phenyl-2,3-hexadienoate #, 2,3-Hexadienoic acid, 2-methyl-4-phenyl-, ethyl ester
| Molecular Formula | C15H18O2 |
|---|---|
| Molecular Weight | 230.13 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 230.13068 |
| Heavy Atoms | 17 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 38701-07-4 |
|---|---|
| SMILES | CCC(=C=C(C)C(=O)OCC)C1=CC=CC=C1 |
| InChIKey | SLXIMBUCQDAIKA-UHFFFAOYSA-N |
Product Overview
Ethyl 2-methyl-4-phenylhexa-2,3-dienoate (CAS 38701-07-4), with molecular formula C15H18O2 and molecular weight 230.13 g/mol. IUPAC: ethyl 2-methyl-4-phenylhexa-2,3-dienoate.
Chemical Property Profile of Ethyl 2-methyl-4-phenylhexa-2,3-dienoate
Property Insights of Ethyl 2-methyl-4-phenylhexa-2,3-dienoate
The XLogP value of 3.6 indicates that Ethyl 2-methyl-4-phenylhexa-2,3-dienoate 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 2-methyl-4-phenylhexa-2,3-dienoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-methyl-4-phenylhexa-2,3-dienoate 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 2-methyl-4-phenylhexa-2,3-dienoate?
The CAS number of Ethyl 2-methyl-4-phenylhexa-2,3-dienoate is 38701-07-4.
What is the molecular formula of Ethyl 2-methyl-4-phenylhexa-2,3-dienoate?
The molecular formula of Ethyl 2-methyl-4-phenylhexa-2,3-dienoate is C15H18O2.
What is the molecular weight of Ethyl 2-methyl-4-phenylhexa-2,3-dienoate?
The molecular weight of Ethyl 2-methyl-4-phenylhexa-2,3-dienoate is 230.13 g/mol.
Where can I buy Ethyl 2-methyl-4-phenylhexa-2,3-dienoate?
You can request a quote for Ethyl 2-methyl-4-phenylhexa-2,3-dienoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-methyl-4-phenylhexa-2,3-dienoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-methyl-4-phenylhexa-2,3-dienoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.