1-Tert-butyl-3-(2-methylphenyl)urea
TL;DR: 1-Tert-butyl-3-(2-methylphenyl)urea (CAS 134627-32-0) is a chemical compound with molecular formula C12H18N2O and molecular weight 206.1419 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-tert-butyl-3-(2-methylphenyl)urea
Also Known As: 1-tert-butyl-3-(2-methylphenyl)urea, N-tert-butyl-N'-(2-methylphenyl)urea, 3-TERT-BUTYL-1-(2-METHYLPHENYL)UREA, [(tert-butyl)amino]-N-(2-methylphenyl)carboxamide
Technical Specifications
| Molecular Formula | C12H18N2O |
| Molecular Weight | 206.1419 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.1419 Da |
| Heavy Atoms | 15 |
| Complexity | 220.0 |
| SMILES | CC1=CC=CC=C1NC(=O)NC(C)(C)C |
| InChIKey | ZGYVGZHSMYBSDV-UHFFFAOYSA-N |
Chemical Property Profile of 1-Tert-butyl-3-(2-methylphenyl)urea
Property Insights of 1-Tert-butyl-3-(2-methylphenyl)urea
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Tert-butyl-3-(2-methylphenyl)urea. With a topological polar surface area (TPSA) of 41.1 Ų, 1-Tert-butyl-3-(2-methylphenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Tert-butyl-3-(2-methylphenyl)urea has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Tert-butyl-3-(2-methylphenyl)urea?
The CAS number of 1-Tert-butyl-3-(2-methylphenyl)urea is 134627-32-0.
What is the molecular formula of 1-Tert-butyl-3-(2-methylphenyl)urea?
The molecular formula of 1-Tert-butyl-3-(2-methylphenyl)urea is C12H18N2O.
What is the molecular weight of 1-Tert-butyl-3-(2-methylphenyl)urea?
The molecular weight of 1-Tert-butyl-3-(2-methylphenyl)urea is 206.1419 g/mol.
Where can I buy 1-Tert-butyl-3-(2-methylphenyl)urea?
You can request a quote for 1-Tert-butyl-3-(2-methylphenyl)urea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Tert-butyl-3-(2-methylphenyl)urea?
Yes, CoreyChem provides custom synthesis services for 1-Tert-butyl-3-(2-methylphenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.