1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]-
TL;DR: 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]- (CAS 71940-93-7) is a chemical compound with molecular formula C8HF12NS4 and molecular weight 466.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,5-tetrakis(trifluoromethylsulfanyl)-1H-pyrrole
Also Known As: 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]-, 2,3,4,5-tetrakis(trifluoromethylthio)pyrrole, 2,3,4,5-tetrakis(trifluoromethylsulfanyl)-1H-pyrrole, 2,3,4,5-Tetrakis[(trifluoromethyl)sulfanyl]-1H-pyrrole, 2,3,4,5-Tetrakis[(trifluoromethyl)sulfanyl]-1H-pyrrole #
| Molecular Formula | C8HF12NS4 |
|---|---|
| Molecular Weight | 466.88 g/mol |
| LogP | 8.3 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 4 |
| Exact Mass | 466.88004 |
| Heavy Atoms | 25 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 71940-93-7 |
|---|---|
| SMILES | C1(=C(NC(=C1SC(F)(F)F)SC(F)(F)F)SC(F)(F)F)SC(F)(F)F |
| InChIKey | NDDDTDLPPCDDNF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]- (CAS 71940-93-7), with molecular formula C8HF12NS4 and molecular weight 466.88 g/mol. IUPAC: 2,3,4,5-tetrakis(trifluoromethylsulfanyl)-1H-pyrrole.
Chemical Property Profile of 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]-
Property Insights of 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]-
The XLogP value of 8.3 indicates that 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]-. Following Lipinski's Rule of Five, 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]- has 1 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]-?
The CAS number of 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]- is 71940-93-7.
What is the molecular formula of 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]-?
The molecular formula of 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]- is C8HF12NS4.
What is the molecular weight of 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]-?
The molecular weight of 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]- is 466.88 g/mol.
Where can I buy 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]-?
You can request a quote for 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrrole, 2,3,4,5-tetrakis[(trifluoromethyl)thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.