Dibenzotetrathiafulvalene
TL;DR: Dibenzotetrathiafulvalene (CAS 61666-73-7) is a chemical compound with molecular formula C14H8S4 and molecular weight 303.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodithiol-2-ylidene)-1,3-benzodithiole
Also Known As: Dibenzotetrathiafulvalene, DBTTF, dibenzo-tetrathiafulvalene, dibenzotetra-thia-fulvalene, dibenzo-tetra-thia-fulvalene
| Molecular Formula | C14H8S4 |
|---|---|
| Molecular Weight | 303.95 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 303.9509 |
| Heavy Atoms | 18 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 61666-73-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)SC(=C3SC4=CC=CC=C4S3)S2 |
| InChIKey | OVIRUXIWCFZJQC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibenzotetrathiafulvalene (CAS 61666-73-7), with molecular formula C14H8S4 and molecular weight 303.95 g/mol. IUPAC: 2-(1,3-benzodithiol-2-ylidene)-1,3-benzodithiole.
Chemical Property Profile of Dibenzotetrathiafulvalene
Property Insights of Dibenzotetrathiafulvalene
The XLogP value of 5.4 indicates that Dibenzotetrathiafulvalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dibenzotetrathiafulvalene. Following Lipinski's Rule of Five, Dibenzotetrathiafulvalene 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 Dibenzotetrathiafulvalene?
The CAS number of Dibenzotetrathiafulvalene is 61666-73-7.
What is the molecular formula of Dibenzotetrathiafulvalene?
The molecular formula of Dibenzotetrathiafulvalene is C14H8S4.
What is the molecular weight of Dibenzotetrathiafulvalene?
The molecular weight of Dibenzotetrathiafulvalene is 303.95 g/mol.
Where can I buy Dibenzotetrathiafulvalene?
You can request a quote for Dibenzotetrathiafulvalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzotetrathiafulvalene?
Yes, KEHONG BIO provides custom synthesis services for Dibenzotetrathiafulvalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.