5-硝基-2-呋喃丙烯酸异丙酯
TL;DR: 5-硝基-2-呋喃丙烯酸异丙酯 (CAS 90147-21-0) 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.
5-硝基-2-呋喃丙烯酸异丙酯
propan-2-yl 3-(5-nitrofuran-2-yl)prop-2-enoate
Also Known As: 5-Nitro-2-furanacrylic acid, isopropyl ester, 5-Nitro-2-furylacrylic acid, isopropyl ester, propan-2-yl 3-(5-nitrofuran-2-yl)prop-2-enoate, 3-(5-Nitro-2-furanyl)-2-propenoic acid 1-methylethyl ester, 2-Propenoic acid, 3-(5-nitro-2-furanyl)-, 1-methylethyl ester
| Molecular Formula | C10H11NO5 |
|---|---|
| Molecular Weight | 225.06 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 85.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.06372 |
| Heavy Atoms | 16 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 90147-21-0 |
|---|---|
| SMILES | CC(C)OC(=O)C=CC1=CC=C(O1)[N+](=O)[O-] |
| InChIKey | GLLASCKJCAXNHF-UHFFFAOYSA-N |
Product Overview
5-硝基-2-呋喃丙烯酸异丙酯 (CAS 90147-21-0), with molecular formula C10H11NO5 and molecular weight 225.06 g/mol. IUPAC: propan-2-yl 3-(5-nitrofuran-2-yl)prop-2-enoate.
Chemical Property Profile of 5-硝基-2-呋喃丙烯酸异丙酯
Property Insights of 5-硝基-2-呋喃丙烯酸异丙酯
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-硝基-2-呋喃丙烯酸异丙酯. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-硝基-2-呋喃丙烯酸异丙酯. Following Lipinski's Rule of Five, 5-硝基-2-呋喃丙烯酸异丙酯 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 5-硝基-2-呋喃丙烯酸异丙酯?
The CAS number of 5-硝基-2-呋喃丙烯酸异丙酯 is 90147-21-0.
What is the molecular formula of 5-硝基-2-呋喃丙烯酸异丙酯?
The molecular formula of 5-硝基-2-呋喃丙烯酸异丙酯 is C10H11NO5.
What is the molecular weight of 5-硝基-2-呋喃丙烯酸异丙酯?
The molecular weight of 5-硝基-2-呋喃丙烯酸异丙酯 is 225.06 g/mol.
Where can I buy 5-硝基-2-呋喃丙烯酸异丙酯?
You can request a quote for 5-硝基-2-呋喃丙烯酸异丙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-硝基-2-呋喃丙烯酸异丙酯?
Yes, KEHONG BIO provides custom synthesis services for 5-硝基-2-呋喃丙烯酸异丙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.