![methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate structure](/static/products/304/304666-02-2.png)
methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate
TL;DR: methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate (CAS 304666-02-2) is a chemical compound with molecular formula C14H13NO5 and molecular weight 275.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-3-(4-acetyloxy-3-methoxyphenyl)-2-cyanoprop-2-enoate
Also Known As: BAS 00632246, methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate, methyl 3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate, 3-(4-Acetoxy-3-methoxy-phenyl)-2-cyano-acrylic acid methyl ester, methyl (E)-3-(4-acetyloxy-3-methoxyphenyl)-2-cyanoprop-2-enoate
| Molecular Formula | C14H13NO5 |
|---|---|
| Molecular Weight | 275.08 g/mol |
| LogP | 1.70048 |
| Topological Polar Surface Area | 85.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 275.07938 |
| Heavy Atoms | 20 |
| Complexity | 598.0721 |
Chemical Identifiers
| CAS Number | 304666-02-2 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)OC)OC |
Product Overview
methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate (CAS 304666-02-2), with molecular formula C14H13NO5 and molecular weight 275.08 g/mol. IUPAC: methyl (E)-3-(4-acetyloxy-3-methoxyphenyl)-2-cyanoprop-2-enoate.
Chemical Property Profile of methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate
Property Insights of methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate
The XLogP value of 1.70048 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate. The TPSA of 85.62 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate. Following Lipinski's Rule of Five, methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate has 0 hydrogen bond donor(s) and 6 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 methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate?
The CAS number of methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate is 304666-02-2.
What is the molecular formula of methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate?
The molecular formula of methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate is C14H13NO5.
What is the molecular weight of methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate?
The molecular weight of methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate is 275.08 g/mol.
Where can I buy methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate?
You can request a quote for methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate?
Yes, KEHONG BIO provides custom synthesis services for methyl (2E)-3-[4-(acetyloxy)-3-methoxyphenyl]-2-cyanoacrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.