p-METHYLACETOPHENONE
TL;DR: p-METHYLACETOPHENONE (CAS 122-00-9) is a chemical compound with molecular formula C9H10O and molecular weight 134.07317 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-methylphenyl)ethanone
Also Known As: 4'-Methylacetophenone, 1-(p-Tolyl)ethanone, p-Methylacetophenone, Melilotal, 4-Acetyltoluene
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H10O |
| Molecular Weight | 134.07317 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 134.07317 Da |
| Heavy Atoms | 10 |
| Complexity | 121.0 |
| Melting Point | 28 °C |
| Boiling Point | 222.00 to 226.00 °C. @ 756.00 mm Hg |
| Density | 0.999-1.010 |
| Vapor Pressure | 0.22 [mmHg] |
| Refractive Index | 1.530-1.536 |
| Solubility | 0.372 mg/mL at 15 °C |
| SMILES | CC1=CC=C(C=C1)C(=O)C |
| InChIKey | GNKZMNRKLCTJAY-UHFFFAOYSA-N |
Product Description
Applications: p-METHYLACETOPHENONE 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).
A heterocyclic building block supplied by CoreyChem, p-METHYLACETOPHENONE (CAS 122-00-9) has the molecular formula C9H10O and a molecular weight of 134.07 g/mol. Reported properties include a density of 0.999-1.010 g/cm³, a solubility: 0.372 mg/mL at 15 °C. Synonyms include 4'-Methylacetophenone and 1-(p-Tolyl)ethanone.
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 p-METHYLACETOPHENONE
Property Insights of p-METHYLACETOPHENONE
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-METHYLACETOPHENONE. With a topological polar surface area (TPSA) of 17.1 Ų, p-METHYLACETOPHENONE exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-METHYLACETOPHENONE has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of p-METHYLACETOPHENONE?
The CAS number of p-METHYLACETOPHENONE is 122-00-9.
What is the molecular formula of p-METHYLACETOPHENONE?
The molecular formula of p-METHYLACETOPHENONE is C9H10O.
What is the molecular weight of p-METHYLACETOPHENONE?
The molecular weight of p-METHYLACETOPHENONE is 134.07317 g/mol.
What are the applications of p-METHYLACETOPHENONE?
p-METHYLACETOPHENONE 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 p-METHYLACETOPHENONE?
You can request a quote for p-METHYLACETOPHENONE directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for p-METHYLACETOPHENONE?
Yes, CoreyChem provides custom synthesis services for p-METHYLACETOPHENONE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.