2,4-二乙酰基间苯三酚
TL;DR: 2,4-二乙酰基间苯三酚 (CAS 2161-86-6) is a chemical compound with molecular formula C10H10O5 and molecular weight 210.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-二乙酰基间苯三酚
1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone
Also Known As: 2,4-Diacetylphloroglucinol, diacetylphloroglucinol, DAPG, K2[pharmaceutical], K-2[pharmaceutical]
| Molecular Formula | C10H10O5 |
|---|---|
| Molecular Weight | 210.05 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.05283 |
| Heavy Atoms | 15 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 2161-86-6 |
|---|---|
| SMILES | CC(=O)C1=C(C(=C(C=C1O)O)C(=O)C)O |
| InChIKey | PIFFQYJYNWXNGE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-二乙酰基间苯三酚 (CAS 2161-86-6), with molecular formula C10H10O5 and molecular weight 210.05 g/mol. IUPAC: 1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone.
Chemical Property Profile of 2,4-二乙酰基间苯三酚
Property Insights of 2,4-二乙酰基间苯三酚
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-二乙酰基间苯三酚. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-二乙酰基间苯三酚. Following Lipinski's Rule of Five, 2,4-二乙酰基间苯三酚 has 3 hydrogen bond donor(s) and 5 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 2,4-二乙酰基间苯三酚?
The CAS number of 2,4-二乙酰基间苯三酚 is 2161-86-6.
What is the molecular formula of 2,4-二乙酰基间苯三酚?
The molecular formula of 2,4-二乙酰基间苯三酚 is C10H10O5.
What is the molecular weight of 2,4-二乙酰基间苯三酚?
The molecular weight of 2,4-二乙酰基间苯三酚 is 210.05 g/mol.
Where can I buy 2,4-二乙酰基间苯三酚?
You can request a quote for 2,4-二乙酰基间苯三酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-二乙酰基间苯三酚?
Yes, KEHONG BIO provides custom synthesis services for 2,4-二乙酰基间苯三酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.