1,3-Bis((trifluoroacetamido)methyl)benzene
TL;DR: 1,3-Bis((trifluoroacetamido)methyl)benzene (CAS 154918-24-8) is a chemical compound with molecular formula C12H10F6N2O2 and molecular weight 328.06464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,2-trifluoro-N-[[3-[[(2,2,2-trifluoroacetyl)amino]methyl]phenyl]methyl]acetamide
Also Known As: N,N'-bis(trifluoroacetyl)-m-xylylenediamine, 1,3-Bis((trifluoroacetamido)methyl)benzene, m-Xylylenediamine, N,N'-bis-trifluoroacetyl-, Acetamide, N,N'-[1,3-phenylenebis(methylene)]bis[2,2,2-trifluoro-, N,N'-(benzene-1,3-diyldimethanediyl)bis(2,2,2-trifluoroacetamide)
Technical Specifications
| Molecular Formula | C12H10F6N2O2 |
| Molecular Weight | 328.06464 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.06464 Da |
| Heavy Atoms | 22 |
| Complexity | 371.0 |
| SMILES | C1=CC(=CC(=C1)CNC(=O)C(F)(F)F)CNC(=O)C(F)(F)F |
| InChIKey | CRJNIESBXQKCDQ-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Bis((trifluoroacetamido)methyl)benzene
Property Insights of 1,3-Bis((trifluoroacetamido)methyl)benzene
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Bis((trifluoroacetamido)methyl)benzene. With a topological polar surface area (TPSA) of 58.2 Ų, 1,3-Bis((trifluoroacetamido)methyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Bis((trifluoroacetamido)methyl)benzene has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,3-Bis((trifluoroacetamido)methyl)benzene?
The CAS number of 1,3-Bis((trifluoroacetamido)methyl)benzene is 154918-24-8.
What is the molecular formula of 1,3-Bis((trifluoroacetamido)methyl)benzene?
The molecular formula of 1,3-Bis((trifluoroacetamido)methyl)benzene is C12H10F6N2O2.
What is the molecular weight of 1,3-Bis((trifluoroacetamido)methyl)benzene?
The molecular weight of 1,3-Bis((trifluoroacetamido)methyl)benzene is 328.06464 g/mol.
Where can I buy 1,3-Bis((trifluoroacetamido)methyl)benzene?
You can request a quote for 1,3-Bis((trifluoroacetamido)methyl)benzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Bis((trifluoroacetamido)methyl)benzene?
Yes, CoreyChem provides custom synthesis services for 1,3-Bis((trifluoroacetamido)methyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.