Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)-
TL;DR: Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)- (CAS 13909-20-1) is a chemical compound with molecular formula C11H14ClN3O2 and molecular weight 255.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)-3-(2,6-dimethylphenyl)-1-nitrosourea
Also Known As: Urea,6-xylyl)-, Urea,6-dimethylphenyl)-N-nitroso-, 1-(2-Chloroethyl)-1-nitroso-3-(2,6-xylyl)urea, Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)-, 1-(2-chloroethyl)-3-(2,6-dimethylphenyl)-1-nitrosourea
| Molecular Formula | C11H14ClN3O2 |
|---|---|
| Molecular Weight | 255.08 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.07745 |
| Heavy Atoms | 17 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 13909-20-1 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)N(CCCl)N=O |
| InChIKey | ZOHKEOXYIXHHCJ-UHFFFAOYSA-N |
Product Overview
Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)- (CAS 13909-20-1), with molecular formula C11H14ClN3O2 and molecular weight 255.08 g/mol. IUPAC: 1-(2-chloroethyl)-3-(2,6-dimethylphenyl)-1-nitrosourea.
Chemical Property Profile of Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)-
Property Insights of Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)-
The XLogP value of 3.2 indicates that Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)-. Following Lipinski's Rule of Five, Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)- 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 Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)-?
The CAS number of Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)- is 13909-20-1.
What is the molecular formula of Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)-?
The molecular formula of Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)- is C11H14ClN3O2.
What is the molecular weight of Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)-?
The molecular weight of Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)- is 255.08 g/mol.
Where can I buy Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)-?
You can request a quote for Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.