alpha-(Methoxymethyl)-5-nitro-2-furancrolein
TL;DR: alpha-(Methoxymethyl)-5-nitro-2-furancrolein (CAS 3455-83-2) is a chemical compound with molecular formula C9H9NO5 and molecular weight 211.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-(methoxymethyl)-3-(5-nitrofuran-2-yl)prop-2-enal
Also Known As: Oxalimidohydrazide, alpha-(Methoxymethyl)-5-nitro-2-furancrolein, 2-Furanacrolein, alpha-(methoxymethyl)-5-nitro-, (E)-2-(methoxymethyl)-3-(5-nitrofuran-2-yl)prop-2-enal
| Molecular Formula | C9H9NO5 |
|---|---|
| Molecular Weight | 211.05 g/mol |
| LogP | 1.4165 |
| Topological Polar Surface Area | 82.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 211.04807 |
| Heavy Atoms | 15 |
| Complexity | 392.96188 |
Chemical Identifiers
| CAS Number | 3455-83-2 |
|---|---|
| SMILES | COC/C(=C\C1=CC=C(O1)[N+](=O)[O-])/C=O |
Product Overview
alpha-(Methoxymethyl)-5-nitro-2-furancrolein (CAS 3455-83-2), with molecular formula C9H9NO5 and molecular weight 211.05 g/mol. IUPAC: (E)-2-(methoxymethyl)-3-(5-nitrofuran-2-yl)prop-2-enal.
Chemical Property Profile of alpha-(Methoxymethyl)-5-nitro-2-furancrolein
Property Insights of alpha-(Methoxymethyl)-5-nitro-2-furancrolein
The XLogP value of 1.4165 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-(Methoxymethyl)-5-nitro-2-furancrolein. The TPSA of 82.58 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-(Methoxymethyl)-5-nitro-2-furancrolein. Following Lipinski's Rule of Five, alpha-(Methoxymethyl)-5-nitro-2-furancrolein 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 alpha-(Methoxymethyl)-5-nitro-2-furancrolein?
The CAS number of alpha-(Methoxymethyl)-5-nitro-2-furancrolein is 3455-83-2.
What is the molecular formula of alpha-(Methoxymethyl)-5-nitro-2-furancrolein?
The molecular formula of alpha-(Methoxymethyl)-5-nitro-2-furancrolein is C9H9NO5.
What is the molecular weight of alpha-(Methoxymethyl)-5-nitro-2-furancrolein?
The molecular weight of alpha-(Methoxymethyl)-5-nitro-2-furancrolein is 211.05 g/mol.
Where can I buy alpha-(Methoxymethyl)-5-nitro-2-furancrolein?
You can request a quote for alpha-(Methoxymethyl)-5-nitro-2-furancrolein directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-(Methoxymethyl)-5-nitro-2-furancrolein?
Yes, KEHONG BIO provides custom synthesis services for alpha-(Methoxymethyl)-5-nitro-2-furancrolein and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.