Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride
TL;DR: Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride (CAS 1081-78-3) is a chemical compound with molecular formula C11H15ClF3N and molecular weight 253.08 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;hydrochloride
Also Known As: 2-methyl-1-[4-(trifluoromethyl)phenyl]propan-2-amine hydrochloride, D 380, D-380, alpha,alpha-Dimethyl-4-(trifluoromethyl)benzeneethanamine hydrochloride, 2-methyl-1-[4-(trifluoromethyl)phenyl]propan-2-amine;hydrochloride
| Molecular Formula | C11H15ClF3N |
|---|---|
| Molecular Weight | 253.08 g/mol |
| LogP | 3.41 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.08452 |
| Heavy Atoms | 16 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 1081-78-3 |
|---|---|
| SMILES | CC(C)(CC1=CC=C(C=C1)C(F)(F)F)N.Cl |
| InChIKey | WLRUMJVHROEIQD-UHFFFAOYSA-N |
Product Overview
Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride (CAS 1081-78-3), with molecular formula C11H15ClF3N and molecular weight 253.08 g/mol. IUPAC: 2-methyl-1-[4-(trifluoromethyl)phenyl]propan-2-amine;hydrochloride.
Chemical Property Profile of Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride
Property Insights of Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride
The XLogP value of 3.41 indicates that Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride 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 Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride?
The CAS number of Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride is 1081-78-3.
What is the molecular formula of Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride?
The molecular formula of Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride is C11H15ClF3N.
What is the molecular weight of Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride?
The molecular weight of Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride is 253.08 g/mol.
Where can I buy Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride?
You can request a quote for Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzeneethanamine, alpha,alpha-dimethyl-4-(trifluoromethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.