![1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate structure](/static/products/893/893754-02-4.png)
1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate
TL;DR: 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate (CAS 893754-02-4) is a chemical compound with molecular formula C18H23NO4 and molecular weight 317.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-cyano-3-(3-ethoxy-4-propan-2-yloxyphenyl)prop-2-enoate
Also Known As: 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate, Propan-2-yl 2-cyano-3-(3-ethoxy-4-propan-2-yloxy-phenyl)prop-2-enoate, propan-2-yl 2-cyano-3-(3-ethoxy-4-propan-2-yloxyphenyl)prop-2-enoate, Propan-2-yl 2-cyano-3-{3-ethoxy-4-[(propan-2-yl)oxy]phenyl}prop-2-enoate
| Molecular Formula | C18H23NO4 |
|---|---|
| Molecular Weight | 317.16 g/mol |
| LogP | 3.73108 |
| Topological Polar Surface Area | 68.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 317.16272 |
| Heavy Atoms | 23 |
| Complexity | 611.93787 |
Chemical Identifiers
| CAS Number | 893754-02-4 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)OC(C)C)OC(C)C |
Product Overview
1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate (CAS 893754-02-4), with molecular formula C18H23NO4 and molecular weight 317.16 g/mol. IUPAC: propan-2-yl 2-cyano-3-(3-ethoxy-4-propan-2-yloxyphenyl)prop-2-enoate.
Chemical Property Profile of 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate
Property Insights of 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate
The XLogP value of 3.73108 indicates that 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate. Following Lipinski's Rule of Five, 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate has 0 hydrogen bond donor(s) and 5 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 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate?
The CAS number of 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate is 893754-02-4.
What is the molecular formula of 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate?
The molecular formula of 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate is C18H23NO4.
What is the molecular weight of 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate?
The molecular weight of 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate is 317.16 g/mol.
Where can I buy 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate?
You can request a quote for 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylethyl 2-cyano-3-[3-ethoxy-4-(1-methylethoxy)phenyl]-2-propenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.