Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate
TL;DR: Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate (CAS 162273-70-3) is a chemical compound with molecular formula C10H9NO3 and molecular weight 191.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-2-cyano-3-(3-methylfuran-2-yl)prop-2-enoate
Also Known As: methyl 2-cyano-3-(3-methyl-2-furyl)acrylate, AE-641/00676002, methyl (E)-2-cyano-3-(3-methylfuran-2-yl)prop-2-enoate
| Molecular Formula | C10H9NO3 |
|---|---|
| Molecular Weight | 191.06 g/mol |
| LogP | 1.668 |
| Topological Polar Surface Area | 63.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 191.05824 |
| Heavy Atoms | 14 |
| Complexity | 409.24677 |
Chemical Identifiers
| CAS Number | 162273-70-3 |
|---|---|
| SMILES | CC1=C(OC=C1)/C=C(\C#N)/C(=O)OC |
Product Overview
Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate (CAS 162273-70-3), with molecular formula C10H9NO3 and molecular weight 191.06 g/mol. IUPAC: methyl (E)-2-cyano-3-(3-methylfuran-2-yl)prop-2-enoate.
Chemical Property Profile of Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate
Property Insights of Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate
The XLogP value of 1.668 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate. The TPSA of 63.23 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate. Following Lipinski's Rule of Five, Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate has 0 hydrogen bond donor(s) and 4 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 2-cyano-3-(3-methyl-2-furyl)acrylate?
The CAS number of Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate is 162273-70-3.
What is the molecular formula of Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate?
The molecular formula of Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate is C10H9NO3.
What is the molecular weight of Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate?
The molecular weight of Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate is 191.06 g/mol.
Where can I buy Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate?
You can request a quote for Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-cyano-3-(3-methyl-2-furyl)acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.