2'-Hydroxyacetophenone
TL;DR: 2'-Hydroxyacetophenone (CAS 118-93-4) is a chemical compound with molecular formula C8H8O2 and molecular weight 136.05243 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-hydroxyphenyl)ethanone
Also Known As: 2'-Hydroxyacetophenone, 2-Acetylphenol, 2-Hydroxyacetophenone, o-Acetylphenol, 1-(2-Hydroxyphenyl)ethanone
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H8O2 |
| Molecular Weight | 136.05243 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 136.05243 Da |
| Heavy Atoms | 10 |
| Complexity | 131.0 |
| Melting Point | 4 - 6 °C |
| Boiling Point | 213.00 °C. @ 717.00 mm Hg |
| Density | 1.127-1.133 |
| Vapor Pressure | 0.00748 [mmHg] |
| Refractive Index | 1.556-1.560 |
| Solubility | slightly soluble in water; soluble in fat |
| SMILES | CC(=O)C1=CC=CC=C1O |
| InChIKey | JECYUBVRTQDVAT-UHFFFAOYSA-N |
Product Description
Applications: 2'-Hydroxyacetophenone is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
2'-Hydroxyacetophenone is a heterocyclic building block identified by CAS number 118-93-4 and the molecular formula C8H8O2 and a molecular weight of 136.05 g/mol. Physically, the compound has a density of 1.127-1.133 g/cm³, a solubility: slightly soluble in water; soluble in fat. Synonyms include 2'-Hydroxyacetophenone and 2-Acetylphenol.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2'-Hydroxyacetophenone
Property Insights of 2'-Hydroxyacetophenone
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2'-Hydroxyacetophenone. With a topological polar surface area (TPSA) of 37.3 Ų, 2'-Hydroxyacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2'-Hydroxyacetophenone has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2'-Hydroxyacetophenone?
The CAS number of 2'-Hydroxyacetophenone is 118-93-4.
What is the molecular formula of 2'-Hydroxyacetophenone?
The molecular formula of 2'-Hydroxyacetophenone is C8H8O2.
What is the molecular weight of 2'-Hydroxyacetophenone?
The molecular weight of 2'-Hydroxyacetophenone is 136.05243 g/mol.
What are the applications of 2'-Hydroxyacetophenone?
2'-Hydroxyacetophenone is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy 2'-Hydroxyacetophenone?
You can request a quote for 2'-Hydroxyacetophenone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2'-Hydroxyacetophenone?
Yes, CoreyChem provides custom synthesis services for 2'-Hydroxyacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.