2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine
TL;DR: 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine (CAS 459-00-7) is a chemical compound with molecular formula C11H14F3N and molecular weight 217.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1-[4-(trifluoromethyl)phenyl]propan-2-amine
Also Known As: 2-methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine, 2-methyl-1-[4-(trifluoromethyl)phenyl]propan-2-amine, 4-(Trifluoromethyl)-alpha,alpha-dimethylbenzeneethanamine, 1,1-DIMETHYL-2-(4-TRIFLUOROMETHYL-PHENYL)-ETHYLAMINE, RefChem:262931
| Molecular Formula | C11H14F3N |
|---|---|
| Molecular Weight | 217.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.10783 |
| Heavy Atoms | 15 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 459-00-7 |
|---|---|
| SMILES | CC(C)(CC1=CC=C(C=C1)C(F)(F)F)N |
| InChIKey | LTPXSOIGSHRNFH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine (CAS 459-00-7), with molecular formula C11H14F3N and molecular weight 217.11 g/mol. IUPAC: 2-methyl-1-[4-(trifluoromethyl)phenyl]propan-2-amine.
Chemical Property Profile of 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine
Property Insights of 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine. With a topological polar surface area (TPSA) of 26.0 Ų, 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine has 1 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-1-(4-(trifluoromethyl)phenyl)propan-2-amine?
The CAS number of 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine is 459-00-7.
What is the molecular formula of 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine?
The molecular formula of 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine is C11H14F3N.
What is the molecular weight of 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine?
The molecular weight of 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine is 217.11 g/mol.
Where can I buy 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine?
You can request a quote for 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-1-(4-(trifluoromethyl)phenyl)propan-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.