![2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol structure](/static/products/219/219618-44-7.png)
2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol
TL;DR: 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol (CAS 219618-44-7) is a chemical compound with molecular formula C11H13F3N2O3 and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-[2-nitro-4-(trifluoromethyl)anilino]propan-1-ol
Also Known As: Maybridge1_001469, 2-methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol, 2-methyl-2-[2-nitro-4-(trifluoromethyl)anilino]propan-1-ol, 2-methyl-2-((2-nitro-4-(trifluoromethyl)phenyl)amino)propan-1-ol
| Molecular Formula | C11H13F3N2O3 |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 2.7964 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.08783 |
| Heavy Atoms | 19 |
| Complexity | 486.56403 |
Chemical Identifiers
| CAS Number | 219618-44-7 |
|---|---|
| SMILES | CC(C)(CO)NC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-] |
Product Overview
2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol (CAS 219618-44-7), with molecular formula C11H13F3N2O3 and molecular weight 278.09 g/mol. IUPAC: 2-methyl-2-[2-nitro-4-(trifluoromethyl)anilino]propan-1-ol.
Chemical Property Profile of 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol
Property Insights of 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol
The XLogP value of 2.7964 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol. Following Lipinski's Rule of Five, 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol has 2 hydrogen bond donor(s) and 4 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 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol?
The CAS number of 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol is 219618-44-7.
What is the molecular formula of 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol?
The molecular formula of 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol is C11H13F3N2O3.
What is the molecular weight of 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol?
The molecular weight of 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol is 278.09 g/mol.
Where can I buy 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol?
You can request a quote for 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.