Hexachlorofulvene
TL;DR: Hexachlorofulvene (CAS 6317-25-5) is a chemical compound with molecular formula C6Cl6 and molecular weight 281.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4-tetrachloro-5-(dichloromethylidene)cyclopenta-1,3-diene
Also Known As: Hexachlorofulvene, Fulvene, Hexachloropentafulvene, C6-Cl6, Perchloro(5-methylenecyclopentadiene)
| Molecular Formula | C6Cl6 |
|---|---|
| Molecular Weight | 281.81 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 283.81018 |
| Heavy Atoms | 12 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 6317-25-5 |
|---|---|
| SMILES | C1(=C(C(=C(Cl)Cl)C(=C1Cl)Cl)Cl)Cl |
| InChIKey | LPXVMSAWPWLKTH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexachlorofulvene (CAS 6317-25-5), with molecular formula C6Cl6 and molecular weight 281.81 g/mol. IUPAC: 1,2,3,4-tetrachloro-5-(dichloromethylidene)cyclopenta-1,3-diene.
Chemical Property Profile of Hexachlorofulvene
Property Insights of Hexachlorofulvene
The XLogP value of 4.5 indicates that Hexachlorofulvene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Hexachlorofulvene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexachlorofulvene has 0 hydrogen bond donor(s) and 0 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 Hexachlorofulvene?
The CAS number of Hexachlorofulvene is 6317-25-5.
What is the molecular formula of Hexachlorofulvene?
The molecular formula of Hexachlorofulvene is C6Cl6.
What is the molecular weight of Hexachlorofulvene?
The molecular weight of Hexachlorofulvene is 281.81 g/mol.
Where can I buy Hexachlorofulvene?
You can request a quote for Hexachlorofulvene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexachlorofulvene?
Yes, KEHONG BIO provides custom synthesis services for Hexachlorofulvene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.