Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride
TL;DR: Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride (CAS 59921-72-1) is a chemical compound with molecular formula C13H19ClFNO and molecular weight 259.11392 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(4-fluorophenyl)-4-oxobutyl]-propan-2-ylazanium chloride
Also Known As: 4'-Fluoro-4-(isopropyl)aminobutyrophenone hydrochloride, [4-(4-fluorophenyl)-4-oxobutyl]-propan-2-ylazanium chloride, BUTYROPHENONE, 4'-FLUORO-4-(ISOPROPYLAMINO)-, HYDROCHLORIDE, 1-Butanone, 1-(4-fluorophenyl)-4-((1-methylethyl)amino)-, hydrochloride
Technical Specifications
| Molecular Formula | C13H19ClFNO |
| Molecular Weight | 259.11392 g/mol |
| XLogP | -1.24 |
| Topological Polar Surface Area (TPSA) | 33.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 259.11392 Da |
| Heavy Atoms | 17 |
| Complexity | 210.0 |
| SMILES | CC(C)[NH2+]CCCC(=O)C1=CC=C(C=C1)F.[Cl-] |
| InChIKey | QAMZKFCELBFJSS-UHFFFAOYSA-N |
Chemical Property Profile of Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride
Property Insights of Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride
The XLogP value of -1.24 indicates that Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.7 Ų, Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride?
The CAS number of Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride is 59921-72-1.
What is the molecular formula of Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride?
The molecular formula of Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride is C13H19ClFNO.
What is the molecular weight of Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride?
The molecular weight of Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride is 259.11392 g/mol.
Where can I buy Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride?
You can request a quote for Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride?
Yes, CoreyChem provides custom synthesis services for Butyrophenone, 4'-fluoro-4-(isopropylamino)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.