p-Nitrosoacetophenone
TL;DR: p-Nitrosoacetophenone (CAS 31125-05-0) is a chemical compound with molecular formula C8H7NO2 and molecular weight 149.04768 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-nitrosophenyl)ethanone
Also Known As: p-Nitrosoacetophenone, 1-Acetyl-4-Nitrosobenzene, 1-(4-Nitrosophenyl)ethanone, Ethanone, 1-(4-nitrosophenyl)-, 1-Nitroso-4-acetylbenzene
Technical Specifications
| Molecular Formula | C8H7NO2 |
| Molecular Weight | 149.04768 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 149.04768 Da |
| Heavy Atoms | 11 |
| Complexity | 159.0 |
| SMILES | CC(=O)C1=CC=C(C=C1)N=O |
| InChIKey | FPAWCBFVQUUUIB-UHFFFAOYSA-N |
Chemical Property Profile of p-Nitrosoacetophenone
Property Insights of p-Nitrosoacetophenone
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Nitrosoacetophenone. With a topological polar surface area (TPSA) of 46.5 Ų, p-Nitrosoacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Nitrosoacetophenone has 0 hydrogen bond donor(s) and 3 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-Nitrosoacetophenone?
The CAS number of p-Nitrosoacetophenone is 31125-05-0.
What is the molecular formula of p-Nitrosoacetophenone?
The molecular formula of p-Nitrosoacetophenone is C8H7NO2.
What is the molecular weight of p-Nitrosoacetophenone?
The molecular weight of p-Nitrosoacetophenone is 149.04768 g/mol.
Where can I buy p-Nitrosoacetophenone?
You can request a quote for p-Nitrosoacetophenone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for p-Nitrosoacetophenone?
Yes, CoreyChem provides custom synthesis services for p-Nitrosoacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.