2-Methyl-3,5-dinitrofuran
TL;DR: 2-Methyl-3,5-dinitrofuran (CAS 3807-87-2) is a chemical compound with molecular formula C5H4N2O5 and molecular weight 172.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3,5-dinitrofuran
Also Known As: 2-methyl-3,5-dinitrofuran, furan, 2-methyl-3,5-dinitro-, 3,5-dinitro-, A-methylfuran, 2-methyl-3,5-dinitro-Furan
| Molecular Formula | C5H4N2O5 |
|---|---|
| Molecular Weight | 172.01 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 172.01202 |
| Heavy Atoms | 12 |
| Complexity | 207.0 |
Chemical Identifiers
| CAS Number | 3807-87-2 |
|---|---|
| SMILES | CC1=C(C=C(O1)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | LWIMEYMSLZJDDZ-UHFFFAOYSA-N |
Product Overview
2-Methyl-3,5-dinitrofuran (CAS 3807-87-2), with molecular formula C5H4N2O5 and molecular weight 172.01 g/mol. IUPAC: 2-methyl-3,5-dinitrofuran.
Chemical Property Profile of 2-Methyl-3,5-dinitrofuran
Property Insights of 2-Methyl-3,5-dinitrofuran
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-3,5-dinitrofuran. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-3,5-dinitrofuran. Following Lipinski's Rule of Five, 2-Methyl-3,5-dinitrofuran 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 2-Methyl-3,5-dinitrofuran?
The CAS number of 2-Methyl-3,5-dinitrofuran is 3807-87-2.
What is the molecular formula of 2-Methyl-3,5-dinitrofuran?
The molecular formula of 2-Methyl-3,5-dinitrofuran is C5H4N2O5.
What is the molecular weight of 2-Methyl-3,5-dinitrofuran?
The molecular weight of 2-Methyl-3,5-dinitrofuran is 172.01 g/mol.
Where can I buy 2-Methyl-3,5-dinitrofuran?
You can request a quote for 2-Methyl-3,5-dinitrofuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-3,5-dinitrofuran?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-3,5-dinitrofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.