Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride
TL;DR: Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride (CAS 59921-79-8) is a chemical compound with molecular formula C17H25ClFNO and molecular weight 313.16086 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
cyclohexyl-[4-(4-fluorophenyl)-4-oxobutyl]-methylazanium chloride
Also Known As: BUTYROPHENONE, 4-(CYCLOHEXYLMETHYLAMINO)-4'-FLUORO-, HYDROCHLORIDE, 4-(N-Cyclohexyl-N-methylamino)-4'-fluorobutyrophenone hydrochloride, cyclohexyl-[4-(4-fluorophenyl)-4-oxobutyl]-methylazanium chloride
Technical Specifications
| Molecular Formula | C17H25ClFNO |
| Molecular Weight | 313.16086 g/mol |
| XLogP | -0.36 |
| Topological Polar Surface Area (TPSA) | 21.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.16086 Da |
| Heavy Atoms | 21 |
| Complexity | 293.0 |
| SMILES | C[NH+](CCCC(=O)C1=CC=C(C=C1)F)C2CCCCC2.[Cl-] |
| InChIKey | ADJBJSVYXIWCLF-UHFFFAOYSA-N |
Chemical Property Profile of Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride
Property Insights of Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride
The XLogP value of -0.36 indicates that Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 21.5 Ų, Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, 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-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride?
The CAS number of Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride is 59921-79-8.
What is the molecular formula of Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride?
The molecular formula of Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride is C17H25ClFNO.
What is the molecular weight of Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride?
The molecular weight of Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride is 313.16086 g/mol.
Where can I buy Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride?
You can request a quote for Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride?
Yes, CoreyChem provides custom synthesis services for Butyrophenone, 4-(cyclohexylmethylamino)-4'-fluoro-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.