Trichloro-1,4-benzoquinone
TL;DR: Trichloro-1,4-benzoquinone (CAS 634-85-5) is a chemical compound with molecular formula C6HCl3O2 and molecular weight 209.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5-trichlorocyclohexa-2,5-diene-1,4-dione
Also Known As: Trichloro-p-benzoquinone, 2,3,5-Trichloro-1,4-benzoquinone, Trichlorchinon, Trichloro-4-benzoquinone, Trichloro-para-benzoquinone
| Molecular Formula | C6HCl3O2 |
|---|---|
| Molecular Weight | 209.90 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.9042 |
| Heavy Atoms | 11 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 634-85-5 |
|---|---|
| SMILES | C1=C(C(=O)C(=C(C1=O)Cl)Cl)Cl |
| InChIKey | KSFNQTZBTVALRV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trichloro-1,4-benzoquinone (CAS 634-85-5), with molecular formula C6HCl3O2 and molecular weight 209.90 g/mol. IUPAC: 2,3,5-trichlorocyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of Trichloro-1,4-benzoquinone
Property Insights of Trichloro-1,4-benzoquinone
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trichloro-1,4-benzoquinone. With a topological polar surface area (TPSA) of 34.1 Ų, Trichloro-1,4-benzoquinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trichloro-1,4-benzoquinone has 0 hydrogen bond donor(s) and 2 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 Trichloro-1,4-benzoquinone?
The CAS number of Trichloro-1,4-benzoquinone is 634-85-5.
What is the molecular formula of Trichloro-1,4-benzoquinone?
The molecular formula of Trichloro-1,4-benzoquinone is C6HCl3O2.
What is the molecular weight of Trichloro-1,4-benzoquinone?
The molecular weight of Trichloro-1,4-benzoquinone is 209.90 g/mol.
Where can I buy Trichloro-1,4-benzoquinone?
You can request a quote for Trichloro-1,4-benzoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trichloro-1,4-benzoquinone?
Yes, KEHONG BIO provides custom synthesis services for Trichloro-1,4-benzoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.