Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d-
TL;DR: Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d- (CAS 24386-94-5) is a chemical compound with molecular formula C13H14F3N and molecular weight 241.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-prop-1-ynyl-1-[3-(trifluoromethyl)phenyl]propan-2-amine
Also Known As: Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d-, d-alpha-Methyl-N-(2-propynyl)-m-trifluoromethylphenethylamine, n-{(2s)-1-[3-(trifluoromethyl)phenyl]propan-2-yl}prop-1-yn-1-amine, (2S)-N-prop-1-ynyl-1-[3-(trifluoromethyl)phenyl]propan-2-amine, n-[(2s)-1-[3-(trifluoromethyl)phenyl]propan-2-yl]prop-1-yn-1-amine
| Molecular Formula | C13H14F3N |
|---|---|
| Molecular Weight | 241.11 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.10783 |
| Heavy Atoms | 17 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 24386-94-5 |
|---|---|
| SMILES | CC#CN[C@@H](C)CC1=CC(=CC=C1)C(F)(F)F |
| InChIKey | DFEAUNLCJKOORV-JTQLQIEISA-N |
Product Overview
Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d- (CAS 24386-94-5), with molecular formula C13H14F3N and molecular weight 241.11 g/mol. IUPAC: (2S)-N-prop-1-ynyl-1-[3-(trifluoromethyl)phenyl]propan-2-amine.
Chemical Property Profile of Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d-
Property Insights of Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d-
The XLogP value of 4.5 indicates that Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d- 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-methyl-N-(2-propynyl)-m-trifluoromethyl-, d-?
The CAS number of Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d- is 24386-94-5.
What is the molecular formula of Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d-?
The molecular formula of Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d- is C13H14F3N.
What is the molecular weight of Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d-?
The molecular weight of Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d- is 241.11 g/mol.
Where can I buy Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d-?
You can request a quote for Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d- 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-(2-propynyl)-m-trifluoromethyl-, d-?
Yes, KEHONG BIO provides custom synthesis services for Phenethylamine, alpha-methyl-N-(2-propynyl)-m-trifluoromethyl-, d- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.