1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene
TL;DR: 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene (CAS 96281-50-4) is a chemical compound with molecular formula C10H11NO5 and molecular weight 225.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate
Also Known As: propyl 3-(5-nitrofuran-2-yl)prop-2-enoate, 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene, J1.598.070B, 3-(5-Nitro-2-furanyl)propenoic acid propyl ester, propyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate
| Molecular Formula | C10H11NO5 |
|---|---|
| Molecular Weight | 225.06 g/mol |
| LogP | 2.1542 |
| Topological Polar Surface Area | 82.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 225.06372 |
| Heavy Atoms | 16 |
| Complexity | 407.09683 |
Chemical Identifiers
| CAS Number | 96281-50-4 |
|---|---|
| SMILES | CCCOC(=O)/C=C/C1=CC=C(O1)[N+](=O)[O-] |
Product Overview
1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene (CAS 96281-50-4), with molecular formula C10H11NO5 and molecular weight 225.06 g/mol. IUPAC: propyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate.
Chemical Property Profile of 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene
Property Insights of 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene
The XLogP value of 2.1542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene. The TPSA of 82.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene. Following Lipinski's Rule of Five, 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene 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-(5-NO2-2-furyl)-2-(COO-Pr)ethylene?
The CAS number of 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene is 96281-50-4.
What is the molecular formula of 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene?
The molecular formula of 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene is C10H11NO5.
What is the molecular weight of 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene?
The molecular weight of 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene is 225.06 g/mol.
Where can I buy 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene?
You can request a quote for 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-NO2-2-furyl)-2-(COO-Pr)ethylene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.