N-(2,2,2-Trichloro-1-hydroxyethyl)urea
TL;DR: N-(2,2,2-Trichloro-1-hydroxyethyl)urea (CAS 2000-40-0) is a chemical compound with molecular formula C3H5Cl3N2O2 and molecular weight 205.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2,2-trichloro-1-hydroxyethyl)urea
Also Known As: Monochloralurea, Chloralurea, Trichloro-ethylol-urea, (1-Hydroxy-2,2,2-trichloroethyl)urea, 1-(2,2,2-trichloro-1-hydroxyethyl)urea
| Molecular Formula | C3H5Cl3N2O2 |
|---|---|
| Molecular Weight | 205.94 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 205.94167 |
| Heavy Atoms | 10 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 2000-40-0 |
|---|---|
| SMILES | C(C(Cl)(Cl)Cl)(NC(=O)N)O |
| InChIKey | VPENXVZFNXARIV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2,2,2-Trichloro-1-hydroxyethyl)urea (CAS 2000-40-0), with molecular formula C3H5Cl3N2O2 and molecular weight 205.94 g/mol. IUPAC: (2,2,2-trichloro-1-hydroxyethyl)urea.
Chemical Property Profile of N-(2,2,2-Trichloro-1-hydroxyethyl)urea
Property Insights of N-(2,2,2-Trichloro-1-hydroxyethyl)urea
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,2,2-Trichloro-1-hydroxyethyl)urea. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,2,2-Trichloro-1-hydroxyethyl)urea. Following Lipinski's Rule of Five, N-(2,2,2-Trichloro-1-hydroxyethyl)urea has 3 hydrogen bond donor(s) and 2 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-(2,2,2-Trichloro-1-hydroxyethyl)urea?
The CAS number of N-(2,2,2-Trichloro-1-hydroxyethyl)urea is 2000-40-0.
What is the molecular formula of N-(2,2,2-Trichloro-1-hydroxyethyl)urea?
The molecular formula of N-(2,2,2-Trichloro-1-hydroxyethyl)urea is C3H5Cl3N2O2.
What is the molecular weight of N-(2,2,2-Trichloro-1-hydroxyethyl)urea?
The molecular weight of N-(2,2,2-Trichloro-1-hydroxyethyl)urea is 205.94 g/mol.
Where can I buy N-(2,2,2-Trichloro-1-hydroxyethyl)urea?
You can request a quote for N-(2,2,2-Trichloro-1-hydroxyethyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,2,2-Trichloro-1-hydroxyethyl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-(2,2,2-Trichloro-1-hydroxyethyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.