N-acetyl-o-toluidine
TL;DR: N-acetyl-o-toluidine (CAS 120-66-1) is a chemical compound with molecular formula C9H11NO and molecular weight 149.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylphenyl)acetamide
Also Known As: o-Acetotoluidide, N-(o-Tolyl)acetamide, o-Acetotoluide, 2'-Methylacetanilide, N-(2-Methylphenyl)acetamide
| Molecular Formula | C9H11NO |
|---|---|
| Molecular Weight | 149.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 149.08406 |
| Heavy Atoms | 11 |
| Complexity | 144.0 |
| Melting Point | 110.0 °C |
| Boiling Point | 296.1 °C at 760 mmHg |
| Density | 1.168 |
| Solubility | Insoluble (NTP, 1992) |
| Vapor Pressure | 0.000183 [mmHg] |
Chemical Identifiers
| CAS Number | 120-66-1 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)C |
| InChIKey | BPEXTIMJLDWDTL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-acetyl-o-toluidine (CAS 120-66-1), with molecular formula C9H11NO and molecular weight 149.08 g/mol. IUPAC: N-(2-methylphenyl)acetamide.
Chemical Property Profile of N-acetyl-o-toluidine
Property Insights of N-acetyl-o-toluidine
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-acetyl-o-toluidine. With a topological polar surface area (TPSA) of 29.1 Ų, N-acetyl-o-toluidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-acetyl-o-toluidine has 1 hydrogen bond donor(s) and 1 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 N-acetyl-o-toluidine?
The CAS number of N-acetyl-o-toluidine is 120-66-1.
What is the molecular formula of N-acetyl-o-toluidine?
The molecular formula of N-acetyl-o-toluidine is C9H11NO.
What is the molecular weight of N-acetyl-o-toluidine?
The molecular weight of N-acetyl-o-toluidine is 149.08 g/mol.
Where can I buy N-acetyl-o-toluidine?
You can request a quote for N-acetyl-o-toluidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-acetyl-o-toluidine?
Yes, KEHONG BIO provides custom synthesis services for N-acetyl-o-toluidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.