Ethyl-1,4-benzoquinone
TL;DR: Ethyl-1,4-benzoquinone (CAS 4754-26-1) is a chemical compound with molecular formula C8H8O2 and molecular weight 136.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylcyclohexa-2,5-diene-1,4-dione
Also Known As: 2-Ethyl-1,4-benzoquinone, Ethyl-1,4-benzoquinone, ethylquinone, 2-Ethylbenzoquinone, p-Benzoquinone, 2-ethyl-
| Molecular Formula | C8H8O2 |
|---|---|
| Molecular Weight | 136.05 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 136.05243 |
| Heavy Atoms | 10 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 4754-26-1 |
|---|---|
| SMILES | CCC1=CC(=O)C=CC1=O |
| InChIKey | IGRSQEOIAAGSGS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl-1,4-benzoquinone (CAS 4754-26-1), with molecular formula C8H8O2 and molecular weight 136.05 g/mol. IUPAC: 2-ethylcyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of Ethyl-1,4-benzoquinone
Property Insights of Ethyl-1,4-benzoquinone
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl-1,4-benzoquinone. With a topological polar surface area (TPSA) of 34.1 Ų, Ethyl-1,4-benzoquinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl-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 Ethyl-1,4-benzoquinone?
The CAS number of Ethyl-1,4-benzoquinone is 4754-26-1.
What is the molecular formula of Ethyl-1,4-benzoquinone?
The molecular formula of Ethyl-1,4-benzoquinone is C8H8O2.
What is the molecular weight of Ethyl-1,4-benzoquinone?
The molecular weight of Ethyl-1,4-benzoquinone is 136.05 g/mol.
Where can I buy Ethyl-1,4-benzoquinone?
You can request a quote for Ethyl-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 Ethyl-1,4-benzoquinone?
Yes, KEHONG BIO provides custom synthesis services for Ethyl-1,4-benzoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.