3-甲基-4-硝基呋咱2(或5)-氧化物
TL;DR: 3-甲基-4-硝基呋咱2(或5)-氧化物 (CAS 49558-02-3) is a chemical compound with molecular formula C3H3N3O4 and molecular weight 145.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-甲基-4-硝基呋咱2(或5)-氧化物
3-methyl-4-nitro-2-oxido-1,2,5-oxadiazol-2-ium
Also Known As: Methylnitrofuroxan, 3-Methyl-4-nitro-furoxan, 3-Methyl-4-nitrofuroxan, 3-methyl-4-nitrofuroxane, 3-methyl-4-nitro-1,2,5-oxadiazole 2-oxide
| Molecular Formula | C3H3N3O4 |
|---|---|
| Molecular Weight | 145.01 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 97.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 145.01236 |
| Heavy Atoms | 10 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 49558-02-3 |
|---|---|
| SMILES | CC1=[N+](ON=C1[N+](=O)[O-])[O-] |
| InChIKey | RGZZPXRWOUTAPT-UHFFFAOYSA-N |
Product Overview
3-甲基-4-硝基呋咱2(或5)-氧化物 (CAS 49558-02-3), with molecular formula C3H3N3O4 and molecular weight 145.01 g/mol. IUPAC: 3-methyl-4-nitro-2-oxido-1,2,5-oxadiazol-2-ium.
Chemical Property Profile of 3-甲基-4-硝基呋咱2(或5)-氧化物
Property Insights of 3-甲基-4-硝基呋咱2(或5)-氧化物
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-甲基-4-硝基呋咱2(或5)-氧化物. The TPSA of 97.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-甲基-4-硝基呋咱2(或5)-氧化物. Following Lipinski's Rule of Five, 3-甲基-4-硝基呋咱2(或5)-氧化物 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 3-甲基-4-硝基呋咱2(或5)-氧化物?
The CAS number of 3-甲基-4-硝基呋咱2(或5)-氧化物 is 49558-02-3.
What is the molecular formula of 3-甲基-4-硝基呋咱2(或5)-氧化物?
The molecular formula of 3-甲基-4-硝基呋咱2(或5)-氧化物 is C3H3N3O4.
What is the molecular weight of 3-甲基-4-硝基呋咱2(或5)-氧化物?
The molecular weight of 3-甲基-4-硝基呋咱2(或5)-氧化物 is 145.01 g/mol.
Where can I buy 3-甲基-4-硝基呋咱2(或5)-氧化物?
You can request a quote for 3-甲基-4-硝基呋咱2(或5)-氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-甲基-4-硝基呋咱2(或5)-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 3-甲基-4-硝基呋咱2(或5)-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.