2,4-Diacetyl-1,3-benzenediol
TL;DR: 2,4-Diacetyl-1,3-benzenediol (CAS 2163-12-4) is a chemical compound with molecular formula C10H10O4 and molecular weight 194.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-acetyl-2,4-dihydroxyphenyl)ethanone
Also Known As: 2,4-Diacetyl-1,3-benzenediol, 2,4-DIACETYLRESORCINOL, 2,4-diacetyl resorcinol, 2,6-Diacetylresorcinol, 1,1'-(2,4-Dihydroxy-1,3-phenylene)bis(ethan-1-one)
| Molecular Formula | C10H10O4 |
|---|---|
| Molecular Weight | 194.06 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.0579 |
| Heavy Atoms | 14 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 2163-12-4 |
|---|---|
| SMILES | CC(=O)C1=C(C(=C(C=C1)O)C(=O)C)O |
| InChIKey | AONRSNZGOMBWPX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Diacetyl-1,3-benzenediol (CAS 2163-12-4), with molecular formula C10H10O4 and molecular weight 194.06 g/mol. IUPAC: 1-(3-acetyl-2,4-dihydroxyphenyl)ethanone.
Chemical Property Profile of 2,4-Diacetyl-1,3-benzenediol
Property Insights of 2,4-Diacetyl-1,3-benzenediol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Diacetyl-1,3-benzenediol. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Diacetyl-1,3-benzenediol. Following Lipinski's Rule of Five, 2,4-Diacetyl-1,3-benzenediol has 2 hydrogen bond donor(s) and 4 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 2,4-Diacetyl-1,3-benzenediol?
The CAS number of 2,4-Diacetyl-1,3-benzenediol is 2163-12-4.
What is the molecular formula of 2,4-Diacetyl-1,3-benzenediol?
The molecular formula of 2,4-Diacetyl-1,3-benzenediol is C10H10O4.
What is the molecular weight of 2,4-Diacetyl-1,3-benzenediol?
The molecular weight of 2,4-Diacetyl-1,3-benzenediol is 194.06 g/mol.
Where can I buy 2,4-Diacetyl-1,3-benzenediol?
You can request a quote for 2,4-Diacetyl-1,3-benzenediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Diacetyl-1,3-benzenediol?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Diacetyl-1,3-benzenediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.