3-(5-Nitro-2-furyl)prop-2-enoic acid
TL;DR: 3-(5-Nitro-2-furyl)prop-2-enoic acid (CAS 6281-23-8) is a chemical compound with molecular formula C7H5NO5 and molecular weight 183.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-nitrofuran-2-yl)prop-2-enoic acid
Also Known As: 3-(5-Nitro-2-furyl)acrylic acid, Nitrofurylacrylamide, zlchem 904, Nitrofurylacrylic acid, 5-Nitrofurylacrylic acid
| Molecular Formula | C7H5NO5 |
|---|---|
| Molecular Weight | 183.02 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.01677 |
| Heavy Atoms | 13 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 6281-23-8 |
|---|---|
| SMILES | C1=C(OC(=C1)[N+](=O)[O-])C=CC(=O)O |
| InChIKey | LWOWNIPZHGWKNR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(5-Nitro-2-furyl)prop-2-enoic acid (CAS 6281-23-8), with molecular formula C7H5NO5 and molecular weight 183.02 g/mol. IUPAC: 3-(5-nitrofuran-2-yl)prop-2-enoic acid.
Chemical Property Profile of 3-(5-Nitro-2-furyl)prop-2-enoic acid
Property Insights of 3-(5-Nitro-2-furyl)prop-2-enoic acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-Nitro-2-furyl)prop-2-enoic acid. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-Nitro-2-furyl)prop-2-enoic acid. Following Lipinski's Rule of Five, 3-(5-Nitro-2-furyl)prop-2-enoic acid has 1 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 3-(5-Nitro-2-furyl)prop-2-enoic acid?
The CAS number of 3-(5-Nitro-2-furyl)prop-2-enoic acid is 6281-23-8.
What is the molecular formula of 3-(5-Nitro-2-furyl)prop-2-enoic acid?
The molecular formula of 3-(5-Nitro-2-furyl)prop-2-enoic acid is C7H5NO5.
What is the molecular weight of 3-(5-Nitro-2-furyl)prop-2-enoic acid?
The molecular weight of 3-(5-Nitro-2-furyl)prop-2-enoic acid is 183.02 g/mol.
Where can I buy 3-(5-Nitro-2-furyl)prop-2-enoic acid?
You can request a quote for 3-(5-Nitro-2-furyl)prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-Nitro-2-furyl)prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-Nitro-2-furyl)prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.