2',6'-Dihydroxyacetophenone
TL;DR: 2',6'-Dihydroxyacetophenone (CAS 699-83-2) is a chemical compound with molecular formula C8H8O3 and molecular weight 152.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dihydroxyphenyl)ethanone
Also Known As: 2',6'-Dihydroxyacetophenone, 1-(2,6-Dihydroxyphenyl)ethanone, 2,6-Dihydroxyacetophenone, 2-Acetylresorcinol, Resorcinol, 2-acetyl-
| Molecular Formula | C8H8O3 |
|---|---|
| Molecular Weight | 152.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 152.04735 |
| Heavy Atoms | 11 |
| Complexity | 145.0 |
| Melting Point | 155 - 156 °C |
Chemical Identifiers
| CAS Number | 699-83-2 |
|---|---|
| SMILES | CC(=O)C1=C(C=CC=C1O)O |
| InChIKey | YPTJKHVBDCRKNF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2',6'-Dihydroxyacetophenone (CAS 699-83-2), with molecular formula C8H8O3 and molecular weight 152.05 g/mol. IUPAC: 1-(2,6-dihydroxyphenyl)ethanone.
Chemical Property Profile of 2',6'-Dihydroxyacetophenone
Property Insights of 2',6'-Dihydroxyacetophenone
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2',6'-Dihydroxyacetophenone. With a topological polar surface area (TPSA) of 57.5 Ų, 2',6'-Dihydroxyacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2',6'-Dihydroxyacetophenone has 2 hydrogen bond donor(s) and 3 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',6'-Dihydroxyacetophenone?
The CAS number of 2',6'-Dihydroxyacetophenone is 699-83-2.
What is the molecular formula of 2',6'-Dihydroxyacetophenone?
The molecular formula of 2',6'-Dihydroxyacetophenone is C8H8O3.
What is the molecular weight of 2',6'-Dihydroxyacetophenone?
The molecular weight of 2',6'-Dihydroxyacetophenone is 152.05 g/mol.
Where can I buy 2',6'-Dihydroxyacetophenone?
You can request a quote for 2',6'-Dihydroxyacetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2',6'-Dihydroxyacetophenone?
Yes, KEHONG BIO provides custom synthesis services for 2',6'-Dihydroxyacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.