1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene
TL;DR: 1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene (CAS 62022-37-1) is a chemical compound with molecular formula C8H6INO5 and molecular weight 322.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(5-iodofuran-2-yl)-2-nitroprop-2-enoate
Also Known As: 1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene, METHYL (2Z)-3-(5-IODOFURAN-2-YL)-2-NITROPROP-2-ENOATE, 2-Propenoic acid, 3-(5-iodo-2-furanyl)-2-nitro-, methyl ester, (E)-, 2-Propenoic acid, 3-(5-iodo-2-furanyl)-2-nitro-, methyl ester, (Z)-
| Molecular Formula | C8H6INO5 |
|---|---|
| Molecular Weight | 322.93 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 85.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.92908 |
| Heavy Atoms | 15 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 62022-37-1 |
|---|---|
| SMILES | COC(=O)C(=CC1=CC=C(O1)I)[N+](=O)[O-] |
| InChIKey | OSWRPHYPKSCAHY-UHFFFAOYSA-N |
Product Overview
1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene (CAS 62022-37-1), with molecular formula C8H6INO5 and molecular weight 322.93 g/mol. IUPAC: methyl 3-(5-iodofuran-2-yl)-2-nitroprop-2-enoate.
Chemical Property Profile of 1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene
Property Insights of 1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene. Following Lipinski's Rule of Five, 1(5-Iodo-2-furyl)-2-NO2-2-COOMe 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-Iodo-2-furyl)-2-NO2-2-COOMe ethylene?
The CAS number of 1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene is 62022-37-1.
What is the molecular formula of 1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene?
The molecular formula of 1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene is C8H6INO5.
What is the molecular weight of 1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene?
The molecular weight of 1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene is 322.93 g/mol.
Where can I buy 1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene?
You can request a quote for 1(5-Iodo-2-furyl)-2-NO2-2-COOMe 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-Iodo-2-furyl)-2-NO2-2-COOMe ethylene?
Yes, KEHONG BIO provides custom synthesis services for 1(5-Iodo-2-furyl)-2-NO2-2-COOMe ethylene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.