Ethanone, 1-(2-amino-3-ethylphenyl)-
TL;DR: Ethanone, 1-(2-amino-3-ethylphenyl)- (CAS 108562-67-0) is a chemical compound with molecular formula C10H13NO and molecular weight 163.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-amino-3-ethylphenyl)ethanone
Also Known As: 1-(2-amino-3-ethylphenyl)ethanone, Ethanone, 1-(2-amino-3-ethylphenyl)-, Benzene, 1-acetyl-2-amino-3-ethyl-, Benzene,1-acetyl-2-amino-3-ethyl, 1-(2-amino-3-ethylphenyl)ethan-1-one
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.10 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 108562-67-0 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)C(=O)C)N |
| InChIKey | HOPFAICNATWMLI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanone, 1-(2-amino-3-ethylphenyl)- (CAS 108562-67-0), with molecular formula C10H13NO and molecular weight 163.10 g/mol. IUPAC: 1-(2-amino-3-ethylphenyl)ethanone.
Chemical Property Profile of Ethanone, 1-(2-amino-3-ethylphenyl)-
Property Insights of Ethanone, 1-(2-amino-3-ethylphenyl)-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(2-amino-3-ethylphenyl)-. With a topological polar surface area (TPSA) of 43.1 Ų, Ethanone, 1-(2-amino-3-ethylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(2-amino-3-ethylphenyl)- 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
Frequently Asked Questions
What is the CAS number of Ethanone, 1-(2-amino-3-ethylphenyl)-?
The CAS number of Ethanone, 1-(2-amino-3-ethylphenyl)- is 108562-67-0.
What is the molecular formula of Ethanone, 1-(2-amino-3-ethylphenyl)-?
The molecular formula of Ethanone, 1-(2-amino-3-ethylphenyl)- is C10H13NO.
What is the molecular weight of Ethanone, 1-(2-amino-3-ethylphenyl)-?
The molecular weight of Ethanone, 1-(2-amino-3-ethylphenyl)- is 163.10 g/mol.
Where can I buy Ethanone, 1-(2-amino-3-ethylphenyl)-?
You can request a quote for Ethanone, 1-(2-amino-3-ethylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(2-amino-3-ethylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(2-amino-3-ethylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.