(1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1)
TL;DR: (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1) (CAS 161692-94-0) is a chemical compound with molecular formula C23H27F2NO3 and molecular weight 403.1959 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
cyclohexanamine;4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxobutanoic acid
Also Known As: (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1), Cyclohexanamine; 4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxo-butanoic Acid, cyclohexanamine; 4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxobutanoic acid, Cyclohexanamine;4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxobutanoic acid, 4-(2',4'-Difluoro[1,1'-biphenyl]-4-yl)-2-methyl-4-oxobutanoic acid--cyclohexanamine (1/1)
Technical Specifications
| Molecular Formula | C23H27F2NO3 |
| Molecular Weight | 403.1959 g/mol |
| XLogP | 5.2031 |
| Topological Polar Surface Area (TPSA) | 80.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.1959 Da |
| Heavy Atoms | 29 |
| Complexity | 451.0 |
| SMILES | CC(CC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)F)F)C(=O)O.C1CCC(CC1)N |
| InChIKey | LFJBVSYVIKGQGO-UHFFFAOYSA-N |
Chemical Property Profile of (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1)
Property Insights of (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1)
The XLogP value of 5.2031 indicates that (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1). Following Lipinski's Rule of Five, (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1) has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1)?
The CAS number of (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1) is 161692-94-0.
What is the molecular formula of (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1)?
The molecular formula of (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1) is C23H27F2NO3.
What is the molecular weight of (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1)?
The molecular weight of (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1) is 403.1959 g/mol.
Where can I buy (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1)?
You can request a quote for (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1)?
Yes, CoreyChem provides custom synthesis services for (1,1'-Biphenyl)-4-butanoic acid, 2',4'-difluoro-alpha-methyl-gamma-oxo-, (+-)-, compd. with cyclohexanamine (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.