3,5-Bis-trifluoromethyl-benzamidine
TL;DR: 3,5-Bis-trifluoromethyl-benzamidine (CAS 125903-78-8) is a chemical compound with molecular formula C9H6F6N2 and molecular weight 256.04352 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5-bis(trifluoromethyl)benzenecarboximidamide
Also Known As: Maybridge4_002982, 3,5-bis-trifluoromethyl-benzamidine, 3,5-bis-trifluoromethylbenzamidine, 3,5-bis(trifluoromethyl)benzene-1-carboximidamide, 3,5-bis(trifluoromethyl)benzenecarboximidamide
Technical Specifications
| Molecular Formula | C9H6F6N2 |
| Molecular Weight | 256.04352 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 49.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 256.04352 Da |
| Heavy Atoms | 17 |
| Complexity | 273.0 |
| SMILES | C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=N)N |
| InChIKey | NKSWBGJHZIMJCJ-UHFFFAOYSA-N |
Chemical Property Profile of 3,5-Bis-trifluoromethyl-benzamidine
Property Insights of 3,5-Bis-trifluoromethyl-benzamidine
The XLogP value of 3.2 indicates that 3,5-Bis-trifluoromethyl-benzamidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.9 Ų, 3,5-Bis-trifluoromethyl-benzamidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Bis-trifluoromethyl-benzamidine has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,5-Bis-trifluoromethyl-benzamidine?
The CAS number of 3,5-Bis-trifluoromethyl-benzamidine is 125903-78-8.
What is the molecular formula of 3,5-Bis-trifluoromethyl-benzamidine?
The molecular formula of 3,5-Bis-trifluoromethyl-benzamidine is C9H6F6N2.
What is the molecular weight of 3,5-Bis-trifluoromethyl-benzamidine?
The molecular weight of 3,5-Bis-trifluoromethyl-benzamidine is 256.04352 g/mol.
Where can I buy 3,5-Bis-trifluoromethyl-benzamidine?
You can request a quote for 3,5-Bis-trifluoromethyl-benzamidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,5-Bis-trifluoromethyl-benzamidine?
Yes, CoreyChem provides custom synthesis services for 3,5-Bis-trifluoromethyl-benzamidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.