Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride
TL;DR: Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride (CAS 75259-18-6) is a chemical compound with molecular formula C14H19ClF3NO and molecular weight 309.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(tert-butylamino)-1-[3-(trifluoromethyl)phenyl]propan-1-one;hydrochloride
Also Known As: Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride, 2-((1,1-Dimethylethyl)amino)-1-(3-trifluoromethylphenyl)-1-propanone hydrochloride, 1-Propanone, 2-((1,1-dimethylethyl)amino)-1-(3-trifluoromethylphenyl)-, hydrochloride, 2-(tert-butylamino)-1-[3-(trifluoromethyl)phenyl]propan-1-one hydrochloride, 2-(tert-Butylamino)-1-[3-(trifluoromethyl)phenyl]propan-1-one--hydrogen chloride (1/1)
| Molecular Formula | C14H19ClF3NO |
|---|---|
| Molecular Weight | 309.11 g/mol |
| LogP | 4.0865 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.11072 |
| Heavy Atoms | 20 |
| Complexity | 466.2222 |
Chemical Identifiers
| CAS Number | 75259-18-6 |
|---|---|
| SMILES | CC(C(=O)C1=CC(=CC=C1)C(F)(F)F)NC(C)(C)C.Cl |
Product Overview
Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride (CAS 75259-18-6), with molecular formula C14H19ClF3NO and molecular weight 309.11 g/mol. IUPAC: 2-(tert-butylamino)-1-[3-(trifluoromethyl)phenyl]propan-1-one;hydrochloride.
Chemical Property Profile of Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride
Property Insights of Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride
The XLogP value of 4.0865 indicates that Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride has 1 hydrogen bond donor(s) and 2 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 Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride?
The CAS number of Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride is 75259-18-6.
What is the molecular formula of Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride?
The molecular formula of Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride is C14H19ClF3NO.
What is the molecular weight of Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride?
The molecular weight of Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride is 309.11 g/mol.
Where can I buy Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride?
You can request a quote for Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Propiophenone, 2-(tert-butylamino)-3'-(trifluoromethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.