2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione
TL;DR: 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione (CAS 33611-73-3) is a chemical compound with molecular formula C14H18Cl2O2 and molecular weight 288.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-ditert-butyl-3,6-dichlorocyclohexa-2,5-diene-1,4-dione
Also Known As: 2,5-ditert-butyl-3,6-dichlorobenzo-1,4-quinone, 2,5-ditert-butyl-3,6-dichlorocyclohexa-2,5-diene-1,4-dione, 2,5-di-tert-butyl-3,6-dichloro-1,4-benzoquinone, 2,5-DI-TERT-BUTYL-3,6-DICHLORO-(1,4)BENZOQUINONE, 2,5-Di-tert-butyl-3,6-dichlorocyclohexa-2,5-diene-1,4-dione
| Molecular Formula | C14H18Cl2O2 |
|---|---|
| Molecular Weight | 288.07 g/mol |
| LogP | 4.2162 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 288.0684 |
| Heavy Atoms | 18 |
| Complexity | 436.90384 |
Chemical Identifiers
| CAS Number | 33611-73-3 |
|---|---|
| SMILES | CC(C)(C)C1=C(C(=O)C(=C(C1=O)Cl)C(C)(C)C)Cl |
Product Overview
2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione (CAS 33611-73-3), with molecular formula C14H18Cl2O2 and molecular weight 288.07 g/mol. IUPAC: 2,5-ditert-butyl-3,6-dichlorocyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione
Property Insights of 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione
The XLogP value of 4.2162 indicates that 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione 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 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione?
The CAS number of 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione is 33611-73-3.
What is the molecular formula of 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione?
The molecular formula of 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione is C14H18Cl2O2.
What is the molecular weight of 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione?
The molecular weight of 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione is 288.07 g/mol.
Where can I buy 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione?
You can request a quote for 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dichloro-3,6-bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.