4,4'-Bis(4-chlorophenyl)tetrathiafulvalene
TL;DR: 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene (CAS 100760-52-9) is a chemical compound with molecular formula C18H10Cl2S4 and molecular weight 423.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-4-(4-chlorophenyl)-2-[4-(4-chlorophenyl)-1,3-dithiol-2-ylidene]-1,3-dithiole
Also Known As: 4,4'-BIS(4-CHLOROPHENYL)TETRATHIAFULVALENE, 4,4'-Bis-(4-chloro-phenyl)-[2,2']bi[[1,3]dithiolylidene], (2E)-4-(4-chlorophenyl)-2-[4-(4-chlorophenyl)-1,3-dithiol-2-ylidene]-1,3-dithiole, 4-(4-chlorophenyl)-2-[4-(4-chlorophenyl)-1,3-dithiol-2-ylidene]-1,3-dithiole, 1,3-Dithiole, 4-(4-chlorophenyl)-2-[4-(4-chlorophenyl)-1,3-dithiol-2-ylidene]-, (E)- (9CI)
| Molecular Formula | C18H10Cl2S4 |
|---|---|
| Molecular Weight | 423.90 g/mol |
| LogP | 8.377 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 423.90424 |
| Heavy Atoms | 24 |
| Complexity | 791.3967 |
Chemical Identifiers
| CAS Number | 100760-52-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CS/C(=C\3/SC=C(S3)C4=CC=C(C=C4)Cl)/S2)Cl |
Product Overview
4,4'-Bis(4-chlorophenyl)tetrathiafulvalene (CAS 100760-52-9), with molecular formula C18H10Cl2S4 and molecular weight 423.90 g/mol. IUPAC: (2E)-4-(4-chlorophenyl)-2-[4-(4-chlorophenyl)-1,3-dithiol-2-ylidene]-1,3-dithiole.
Chemical Property Profile of 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene
Property Insights of 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene
The XLogP value of 8.377 indicates that 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene?
The CAS number of 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene is 100760-52-9.
What is the molecular formula of 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene?
The molecular formula of 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene is C18H10Cl2S4.
What is the molecular weight of 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene?
The molecular weight of 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene is 423.90 g/mol.
Where can I buy 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene?
You can request a quote for 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Bis(4-chlorophenyl)tetrathiafulvalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.