Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl-
TL;DR: Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl- (CAS 1645-09-6) 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-[3-(trifluoromethyl)phenyl]propan-2-amine
Also Known As: 2-methyl-1-[3-(trifluoromethyl)phenyl]propan-2-amine, Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl-, alpha,alpha-Dimethyl-m-trifluoromethylphenethylamine, 1,1-DIMETHYL-2-(3-TRIFLUOROMETHYL-PHENYL)-ETHYLAMINE, 2-Methyl-1-(3-(trifluoromethyl)phenyl)propan-2-amine
| 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 | 210.0 |
Chemical Identifiers
| CAS Number | 1645-09-6 |
|---|---|
| SMILES | CC(C)(CC1=CC(=CC=C1)C(F)(F)F)N |
| InChIKey | CUEVAAQJHCRHJI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl- (CAS 1645-09-6), with molecular formula C11H14F3N and molecular weight 217.11 g/mol. IUPAC: 2-methyl-1-[3-(trifluoromethyl)phenyl]propan-2-amine.
Chemical Property Profile of Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl-
Property Insights of Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl-. With a topological polar surface area (TPSA) of 26.0 Ų, Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl- 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 Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl-?
The CAS number of Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl- is 1645-09-6.
What is the molecular formula of Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl-?
The molecular formula of Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl- is C11H14F3N.
What is the molecular weight of Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl-?
The molecular weight of Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl- is 217.11 g/mol.
Where can I buy Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl-?
You can request a quote for Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl-?
Yes, KEHONG BIO provides custom synthesis services for Phenethylamine, alpha,alpha-dimethyl-m-trifluoromethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.