6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione
TL;DR: 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione (CAS 85573-01-9) is a chemical compound with molecular formula C5HF8N3O2 and molecular weight 286.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,6-difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione
Also Known As: 6,6-difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione, 6,6-difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-d, 3,5-bis(trifluoromethyl)-4,4-difluoro-1,3,5-tri-aza-2,6-cyclohexanedione, RefChem:306038
| Molecular Formula | C5HF8N3O2 |
|---|---|
| Molecular Weight | 286.99 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 52.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 0 |
| Exact Mass | 286.9941 |
| Heavy Atoms | 18 |
| Complexity | 353.0 |
Chemical Identifiers
| CAS Number | 85573-01-9 |
|---|---|
| SMILES | C1(=O)NC(=O)N(C(N1C(F)(F)F)(F)F)C(F)(F)F |
| InChIKey | SFQZWXPIYIXDEW-UHFFFAOYSA-N |
Product Overview
6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione (CAS 85573-01-9), with molecular formula C5HF8N3O2 and molecular weight 286.99 g/mol. IUPAC: 6,6-difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione.
Chemical Property Profile of 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione
Property Insights of 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione. With a topological polar surface area (TPSA) of 52.7 Ų, 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione has 1 hydrogen bond donor(s) and 10 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 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione?
The CAS number of 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione is 85573-01-9.
What is the molecular formula of 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione?
The molecular formula of 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione is C5HF8N3O2.
What is the molecular weight of 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione?
The molecular weight of 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione is 286.99 g/mol.
Where can I buy 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione?
You can request a quote for 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 6,6-Difluoro-1,5-bis(trifluoromethyl)-1,3,5-triazinane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.