3'-Aminoacetophenone
TL;DR: 3'-Aminoacetophenone (CAS 99-03-6) 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-(3-aminophenyl)ethanone
Also Known As: 3'-Aminoacetophenone, 1-(3-Aminophenyl)ethanone, 3-Acetylaniline, m-Aminoacetophenone, 3-AMINOACETOPHENONE
Application Areas
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H9NO |
| Molecular Weight | 135.06842 g/mol |
| XLogP | 1.2 |
| 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 |
| SMILES | CC(=O)C1=CC(=CC=C1)N |
| InChIKey | CKQHAYFOPRIUOM-UHFFFAOYSA-N |
Product Description
Applications: 3'-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. CoreyChem supplies 3'-Aminoacetophenone (CAS 99-03-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
3'-Aminoacetophenone is a heterocyclic building block identified by CAS number 99-03-6 and the molecular formula C8H9NO and a molecular weight of 135.07 g/mol. It is also known as 3'-Aminoacetophenone and 1-(3-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 3'-Aminoacetophenone
Property Insights of 3'-Aminoacetophenone
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3'-Aminoacetophenone. With a topological polar surface area (TPSA) of 43.1 Ų, 3'-Aminoacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3'-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 3'-Aminoacetophenone?
The CAS number of 3'-Aminoacetophenone is 99-03-6.
What is the molecular formula of 3'-Aminoacetophenone?
The molecular formula of 3'-Aminoacetophenone is C8H9NO.
What is the molecular weight of 3'-Aminoacetophenone?
The molecular weight of 3'-Aminoacetophenone is 135.06842 g/mol.
What are the applications of 3'-Aminoacetophenone?
3'-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. CoreyChem supplies 3'-Aminoacetophenone (CAS 99-03-6)...
Where can I buy 3'-Aminoacetophenone?
You can request a quote for 3'-Aminoacetophenone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3'-Aminoacetophenone?
Yes, CoreyChem provides custom synthesis services for 3'-Aminoacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.