1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride
TL;DR: 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride (CAS 161199-95-7) is a chemical compound with molecular formula C13H19ClFNO3 and molecular weight 291.10376 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)propan-1-one;hydrochloride
Also Known As: 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride, 3-(Dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-1-propanone hydrochloride, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)propan-1-one hydrochloride, 3-(Dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)propan-1-one--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C13H19ClFNO3 |
| Molecular Weight | 291.10376 g/mol |
| XLogP | 2.3991 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 291.10376 Da |
| Heavy Atoms | 19 |
| Complexity | 273.0 |
| SMILES | CN(C)CCC(=O)C1=CC(=C(C=C1F)OC)OC.Cl |
| InChIKey | MLUAKTJPYXQGFG-UHFFFAOYSA-N |
Chemical Property Profile of 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride
Property Insights of 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride
The XLogP value of 2.3991 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride. With a topological polar surface area (TPSA) of 38.8 Ų, 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride?
The CAS number of 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride is 161199-95-7.
What is the molecular formula of 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride?
The molecular formula of 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride is C13H19ClFNO3.
What is the molecular weight of 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride?
The molecular weight of 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride is 291.10376 g/mol.
Where can I buy 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride?
You can request a quote for 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride?
Yes, CoreyChem provides custom synthesis services for 1-Propanone, 3-(dimethylamino)-1-(2-fluoro-4,5-dimethoxyphenyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.