Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso-
TL;DR: Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso- (CAS 69112-99-8) is a chemical compound with molecular formula C6H11Cl2N3O2 and molecular weight 227.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-bis(2-chloroethyl)-3-methyl-3-nitrosourea
Also Known As: Nitrosomethylbis(chloroethyl)urea, Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso-, N-nitroso-methyl-bis-chloroethylurea, 1,1-Bis-(2-chloroethyl)-3-methyl-3-nitrosourea, 1-Nitroso-1-methyl-3,3-bis-(2-chloroethyl)urea
| Molecular Formula | C6H11Cl2N3O2 |
|---|---|
| Molecular Weight | 227.02 g/mol |
| LogP | 1.4992 |
| Topological Polar Surface Area | 52.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 227.02283 |
| Heavy Atoms | 13 |
| Complexity | 173.2623 |
Chemical Identifiers
| CAS Number | 69112-99-8 |
|---|---|
| SMILES | CN(C(=O)N(CCCl)CCCl)N=O |
Product Overview
Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso- (CAS 69112-99-8), with molecular formula C6H11Cl2N3O2 and molecular weight 227.02 g/mol. IUPAC: 1,1-bis(2-chloroethyl)-3-methyl-3-nitrosourea.
Chemical Property Profile of Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso-
Property Insights of Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso-
The XLogP value of 1.4992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso-. With a topological polar surface area (TPSA) of 52.98 Ų, Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso- has 0 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, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso-?
The CAS number of Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso- is 69112-99-8.
What is the molecular formula of Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso-?
The molecular formula of Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso- is C6H11Cl2N3O2.
What is the molecular weight of Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso-?
The molecular weight of Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso- is 227.02 g/mol.
Where can I buy Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso-?
You can request a quote for Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1,1-bis(2-chloroethyl)-3-methyl-3-nitroso- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.