![1-[(4-Nitrobenzyl)oxy]urea structure](/static/products/3134/31348-80-8.webp)
1-[(4-Nitrobenzyl)oxy]urea
TL;DR: 1-[(4-Nitrobenzyl)oxy]urea (CAS 31348-80-8) is a chemical compound with molecular formula C8H9N3O4 and molecular weight 211.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl)methoxyurea
Also Known As: 1-[(4-nitrobenzyl)oxy]urea, (4-nitrophenyl)methoxyurea, [(4-nitrophenyl)methoxy]urea, N-[(4-nitrobenzyl)oxy]urea, 1-(4-Nitrobenzyloxy)urea
| Molecular Formula | C8H9N3O4 |
|---|---|
| Molecular Weight | 211.06 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.05931 |
| Heavy Atoms | 15 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 31348-80-8 |
|---|---|
| SMILES | C1=CC(=CC=C1CONC(=O)N)[N+](=O)[O-] |
| InChIKey | NIRQVZUQDNTANO-UHFFFAOYSA-N |
Product Overview
1-[(4-Nitrobenzyl)oxy]urea (CAS 31348-80-8), with molecular formula C8H9N3O4 and molecular weight 211.06 g/mol. IUPAC: (4-nitrophenyl)methoxyurea.
Chemical Property Profile of 1-[(4-Nitrobenzyl)oxy]urea
Property Insights of 1-[(4-Nitrobenzyl)oxy]urea
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-Nitrobenzyl)oxy]urea. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(4-Nitrobenzyl)oxy]urea. Following Lipinski's Rule of Five, 1-[(4-Nitrobenzyl)oxy]urea has 2 hydrogen bond donor(s) and 4 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 1-[(4-Nitrobenzyl)oxy]urea?
The CAS number of 1-[(4-Nitrobenzyl)oxy]urea is 31348-80-8.
What is the molecular formula of 1-[(4-Nitrobenzyl)oxy]urea?
The molecular formula of 1-[(4-Nitrobenzyl)oxy]urea is C8H9N3O4.
What is the molecular weight of 1-[(4-Nitrobenzyl)oxy]urea?
The molecular weight of 1-[(4-Nitrobenzyl)oxy]urea is 211.06 g/mol.
Where can I buy 1-[(4-Nitrobenzyl)oxy]urea?
You can request a quote for 1-[(4-Nitrobenzyl)oxy]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-Nitrobenzyl)oxy]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Nitrobenzyl)oxy]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.