![N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea structure](/static/products/3391/339111-00-1.webp)
N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea
TL;DR: N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea (CAS 339111-00-1) is a chemical compound with molecular formula C11H15N3O3 and molecular weight 237.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dimethyl-3-[2-(2-nitroethyl)phenyl]urea
Also Known As: 3,3-dimethyl-1-[2-(2-nitroethyl)phenyl]urea, N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea, 1,1-dimethyl-3-[2-(2-nitroethyl)phenyl]urea, N,N-Dimethyl-N'-(2-(2-nitroethyl)phenyl)urea
| Molecular Formula | C11H15N3O3 |
|---|---|
| Molecular Weight | 237.11 g/mol |
| LogP | 1.5993 |
| Topological Polar Surface Area | 75.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 237.11134 |
| Heavy Atoms | 17 |
| Complexity | 418.1776 |
Chemical Identifiers
| CAS Number | 339111-00-1 |
|---|---|
| SMILES | CN(C)C(=O)NC1=CC=CC=C1CC[N+](=O)[O-] |
Product Overview
N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea (CAS 339111-00-1), with molecular formula C11H15N3O3 and molecular weight 237.11 g/mol. IUPAC: 1,1-dimethyl-3-[2-(2-nitroethyl)phenyl]urea.
Chemical Property Profile of N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea
Property Insights of N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea
The XLogP value of 1.5993 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea. The TPSA of 75.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea. Following Lipinski's Rule of Five, N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea has 1 hydrogen bond donor(s) and 3 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 N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea?
The CAS number of N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea is 339111-00-1.
What is the molecular formula of N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea?
The molecular formula of N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea is C11H15N3O3.
What is the molecular weight of N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea?
The molecular weight of N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea is 237.11 g/mol.
Where can I buy N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea?
You can request a quote for N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea?
Yes, KEHONG BIO provides custom synthesis services for N,N-dimethyl-N'-[2-(2-nitroethyl)phenyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.