Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl-
TL;DR: Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl- (CAS 52777-74-9) is a chemical compound with molecular formula C13H18F3N and molecular weight 245.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-propyl-1-[3-(trifluoromethyl)phenyl]propan-2-amine
Also Known As: Fenfluramine Impurity 1, alpha-Methyl-N-propyl-m-trifluoromethylphenethylamine, N-propyl-1-[3-(trifluoromethyl)phenyl]propan-2-amine, Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl-, alpha-Methyl-N-propyl-3-(trifluoromethyl)benzeneethanamine
| Molecular Formula | C13H18F3N |
|---|---|
| Molecular Weight | 245.14 g/mol |
| LogP | 3.636 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 245.13913 |
| Heavy Atoms | 17 |
| Complexity | 346.76297 |
Chemical Identifiers
| CAS Number | 52777-74-9 |
|---|---|
| SMILES | CCCNC(C)CC1=CC(=CC=C1)C(F)(F)F |
Product Overview
Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl- (CAS 52777-74-9), with molecular formula C13H18F3N and molecular weight 245.14 g/mol. IUPAC: N-propyl-1-[3-(trifluoromethyl)phenyl]propan-2-amine.
Chemical Property Profile of Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl-
Property Insights of Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl-
The XLogP value of 3.636 indicates that Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl- has 1 hydrogen bond donor(s) and 1 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-methyl-N-propyl-m-trifluoromethyl-?
The CAS number of Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl- is 52777-74-9.
What is the molecular formula of Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl-?
The molecular formula of Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl- is C13H18F3N.
What is the molecular weight of Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl-?
The molecular weight of Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl- is 245.14 g/mol.
Where can I buy Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl-?
You can request a quote for Phenethylamine, alpha-methyl-N-propyl-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-methyl-N-propyl-m-trifluoromethyl-?
Yes, KEHONG BIO provides custom synthesis services for Phenethylamine, alpha-methyl-N-propyl-m-trifluoromethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.