N-Nitroso-N-(1-phenylethyl)urea
TL;DR: N-Nitroso-N-(1-phenylethyl)urea (CAS 102996-62-3) is a chemical compound with molecular formula C9H11N3O2 and molecular weight 193.08513 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-nitroso-1-(1-phenylethyl)urea
Also Known As: N-Nitroso-N-(1-phenylethyl)urea, N-nitroso-1-phenylethylurea, 1-nitroso-1-(1-phenylethyl)urea, Urea, N-nitroso-N-(1-phenylethyl)-, N-nitroso-N-(1-phenylethyl)-Urea
Technical Specifications
| Molecular Formula | C9H11N3O2 |
| Molecular Weight | 193.08513 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 75.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.08513 Da |
| Heavy Atoms | 14 |
| Complexity | 214.0 |
| SMILES | CC(C1=CC=CC=C1)N(C(=O)N)N=O |
| InChIKey | FTDGCDAWXUYWNR-UHFFFAOYSA-N |
Chemical Property Profile of N-Nitroso-N-(1-phenylethyl)urea
Property Insights of N-Nitroso-N-(1-phenylethyl)urea
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Nitroso-N-(1-phenylethyl)urea. The TPSA of 75.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Nitroso-N-(1-phenylethyl)urea. Following Lipinski's Rule of Five, N-Nitroso-N-(1-phenylethyl)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
What is the CAS number of N-Nitroso-N-(1-phenylethyl)urea?
The CAS number of N-Nitroso-N-(1-phenylethyl)urea is 102996-62-3.
What is the molecular formula of N-Nitroso-N-(1-phenylethyl)urea?
The molecular formula of N-Nitroso-N-(1-phenylethyl)urea is C9H11N3O2.
What is the molecular weight of N-Nitroso-N-(1-phenylethyl)urea?
The molecular weight of N-Nitroso-N-(1-phenylethyl)urea is 193.08513 g/mol.
Where can I buy N-Nitroso-N-(1-phenylethyl)urea?
You can request a quote for N-Nitroso-N-(1-phenylethyl)urea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-Nitroso-N-(1-phenylethyl)urea?
Yes, CoreyChem provides custom synthesis services for N-Nitroso-N-(1-phenylethyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.