Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso-
TL;DR: Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso- (CAS 33021-94-2) is a chemical compound with molecular formula C9H14ClN3O2 and molecular weight 231.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)-3-cyclohex-2-en-1-yl-1-nitrosourea
Also Known As: NSC 132,921, 1-(2-chloroethyl)-3-cyclohex-2-en-1-yl-1-nitrosourea, 1-(2-Chloroethyl)-3-(2-cyclohexenyl)-1-nitrosourea, Urea, 1-(2-chloroethyl)-3-(2-cyclohexenyl)-1-nitroso-, N-(2-Chloroethyl)-N'-2-cyclohexenyl-N-nitrosourea
| Molecular Formula | C9H14ClN3O2 |
|---|---|
| Molecular Weight | 231.08 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.07745 |
| Heavy Atoms | 15 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 33021-94-2 |
|---|---|
| SMILES | C1CC=CC(C1)NC(=O)N(CCCl)N=O |
| InChIKey | QRKPIRZTUBAFCF-UHFFFAOYSA-N |
Product Overview
Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso- (CAS 33021-94-2), with molecular formula C9H14ClN3O2 and molecular weight 231.08 g/mol. IUPAC: 1-(2-chloroethyl)-3-cyclohex-2-en-1-yl-1-nitrosourea.
Chemical Property Profile of Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso-
Property Insights of Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso-. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso-. Following Lipinski's Rule of Five, Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso- 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, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso-?
The CAS number of Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso- is 33021-94-2.
What is the molecular formula of Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso-?
The molecular formula of Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso- is C9H14ClN3O2.
What is the molecular weight of Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso-?
The molecular weight of Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso- is 231.08 g/mol.
Where can I buy Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso-?
You can request a quote for Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso-?
Yes, KEHONG BIO provides custom synthesis services for Urea, N-(2-chloroethyl)-N'-2-cyclohexenyl-N-nitroso- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.