2'-Aminoacetophenone
TL;DR: 2'-Aminoacetophenone (CAS 551-93-9) is a chemical compound with molecular formula C8H9NO and molecular weight 135.06842 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-aminophenyl)ethanone
Also Known As: 2'-Aminoacetophenone, 1-(2-Aminophenyl)ethanone, 2-Acetylaniline, 2-Aminoacetophenone, o-Acetylaniline
Application Areas
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H9NO |
| Molecular Weight | 135.06842 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 135.06842 Da |
| Heavy Atoms | 10 |
| Complexity | 133.0 |
| Melting Point | 20 °C |
| Boiling Point | BP 250-252 °C @ 760 MM HG (SOME DECOMP) |
| Density | 1.115-1.121 |
| Vapor Pressure | 0.00989 [mmHg] |
| Refractive Index | INDEX OF REFRACTION: 1.6160 @ 20 °C/D; MAX ABSORPTION (ALC): 226 NM (LOG E= 4.32), 254 NM (LOG E= 3.75), 359 NM (LOG E= 3.64) |
| Solubility | PRACTICALLY INSOL IN WATER; SOL IN ALC |
| SMILES | CC(=O)C1=CC=CC=C1N |
| InChIKey | GTDQGKWDWVUKTI-UHFFFAOYSA-N |
Product Description
Applications: 2'-Aminoacetophenone 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'-Aminoacetophenone (CAS 551-93-9) is a heterocyclic building block with the molecular formula C8H9NO and a molecular weight of 135.07 g/mol. Key physical properties include a density of 1.115-1.121 g/cm³, a solubility: PRACTICALLY INSOL IN WATER; SOL IN ALC. Synonyms include 2'-Aminoacetophenone and 1-(2-Aminophenyl)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 2'-Aminoacetophenone
Property Insights of 2'-Aminoacetophenone
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2'-Aminoacetophenone. With a topological polar surface area (TPSA) of 43.1 Ų, 2'-Aminoacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2'-Aminoacetophenone 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'-Aminoacetophenone?
The CAS number of 2'-Aminoacetophenone is 551-93-9.
What is the molecular formula of 2'-Aminoacetophenone?
The molecular formula of 2'-Aminoacetophenone is C8H9NO.
What is the molecular weight of 2'-Aminoacetophenone?
The molecular weight of 2'-Aminoacetophenone is 135.06842 g/mol.
What are the applications of 2'-Aminoacetophenone?
2'-Aminoacetophenone 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'-Aminoacetophenone?
You can request a quote for 2'-Aminoacetophenone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2'-Aminoacetophenone?
Yes, CoreyChem provides custom synthesis services for 2'-Aminoacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.