2-Amino-1-(2,4,5-trimethylphenyl)ethanone
TL;DR: 2-Amino-1-(2,4,5-trimethylphenyl)ethanone (CAS 69872-38-4) is a chemical compound with molecular formula C11H15NO and molecular weight 177.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-(2,4,5-trimethylphenyl)ethanone
Also Known As: 2-amino-1-(2,4,5-trimethylphenyl)ethanone, 2-amino-1-(2,4,5-trimethylphenyl)ethan-1-one, Ethanone, 2-amino-1-(2,4,5-trimethylphenyl)-
| Molecular Formula | C11H15NO |
|---|---|
| Molecular Weight | 177.12 g/mol |
| LogP | 1.75326 |
| Topological Polar Surface Area | 43.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 177.11537 |
| Heavy Atoms | 13 |
| Complexity | 342.18866 |
Chemical Identifiers
| CAS Number | 69872-38-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1C)C(=O)CN)C |
Product Overview
2-Amino-1-(2,4,5-trimethylphenyl)ethanone (CAS 69872-38-4), with molecular formula C11H15NO and molecular weight 177.12 g/mol. IUPAC: 2-amino-1-(2,4,5-trimethylphenyl)ethanone.
Chemical Property Profile of 2-Amino-1-(2,4,5-trimethylphenyl)ethanone
Property Insights of 2-Amino-1-(2,4,5-trimethylphenyl)ethanone
The XLogP value of 1.75326 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-1-(2,4,5-trimethylphenyl)ethanone. With a topological polar surface area (TPSA) of 43.09 Ų, 2-Amino-1-(2,4,5-trimethylphenyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Amino-1-(2,4,5-trimethylphenyl)ethanone 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 2-Amino-1-(2,4,5-trimethylphenyl)ethanone?
The CAS number of 2-Amino-1-(2,4,5-trimethylphenyl)ethanone is 69872-38-4.
What is the molecular formula of 2-Amino-1-(2,4,5-trimethylphenyl)ethanone?
The molecular formula of 2-Amino-1-(2,4,5-trimethylphenyl)ethanone is C11H15NO.
What is the molecular weight of 2-Amino-1-(2,4,5-trimethylphenyl)ethanone?
The molecular weight of 2-Amino-1-(2,4,5-trimethylphenyl)ethanone is 177.12 g/mol.
Where can I buy 2-Amino-1-(2,4,5-trimethylphenyl)ethanone?
You can request a quote for 2-Amino-1-(2,4,5-trimethylphenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-1-(2,4,5-trimethylphenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-1-(2,4,5-trimethylphenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.