4,5-Bis(trifluoromethyl)benzene-1,2-diamine
TL;DR: 4,5-Bis(trifluoromethyl)benzene-1,2-diamine (CAS 30454-92-3) is a chemical compound with molecular formula C8H6F6N2 and molecular weight 244.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-bis(trifluoromethyl)benzene-1,2-diamine
Also Known As: 4,5-bis(trifluoromethyl)benzene-1,2-diamine, 1,2-Benzenediamine,4,5-bis(trifluoromethyl)-, 4,5-bis(trifluoromethyl)-1,2-benzenediamine, 4,5-bis-trifluoromethyl-benzene-1,2-diamine, 4,5-bis(trifluoromethyl)-1,2-phenylenediamine
| Molecular Formula | C8H6F6N2 |
|---|---|
| Molecular Weight | 244.04 g/mol |
| LogP | 2.8886 |
| Topological Polar Surface Area | 52.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 244.04352 |
| Heavy Atoms | 16 |
| Complexity | 367.21518 |
Chemical Identifiers
| CAS Number | 30454-92-3 |
|---|---|
| SMILES | C1=C(C(=CC(=C1N)N)C(F)(F)F)C(F)(F)F |
Product Overview
4,5-Bis(trifluoromethyl)benzene-1,2-diamine (CAS 30454-92-3), with molecular formula C8H6F6N2 and molecular weight 244.04 g/mol. IUPAC: 4,5-bis(trifluoromethyl)benzene-1,2-diamine.
Chemical Property Profile of 4,5-Bis(trifluoromethyl)benzene-1,2-diamine
Property Insights of 4,5-Bis(trifluoromethyl)benzene-1,2-diamine
The XLogP value of 2.8886 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Bis(trifluoromethyl)benzene-1,2-diamine. With a topological polar surface area (TPSA) of 52.04 Ų, 4,5-Bis(trifluoromethyl)benzene-1,2-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Bis(trifluoromethyl)benzene-1,2-diamine has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,5-Bis(trifluoromethyl)benzene-1,2-diamine?
The CAS number of 4,5-Bis(trifluoromethyl)benzene-1,2-diamine is 30454-92-3.
What is the molecular formula of 4,5-Bis(trifluoromethyl)benzene-1,2-diamine?
The molecular formula of 4,5-Bis(trifluoromethyl)benzene-1,2-diamine is C8H6F6N2.
What is the molecular weight of 4,5-Bis(trifluoromethyl)benzene-1,2-diamine?
The molecular weight of 4,5-Bis(trifluoromethyl)benzene-1,2-diamine is 244.04 g/mol.
Where can I buy 4,5-Bis(trifluoromethyl)benzene-1,2-diamine?
You can request a quote for 4,5-Bis(trifluoromethyl)benzene-1,2-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Bis(trifluoromethyl)benzene-1,2-diamine?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Bis(trifluoromethyl)benzene-1,2-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.