2-Acetylamino-4-aminotoluene
TL;DR: 2-Acetylamino-4-aminotoluene (CAS 5434-30-0) is a chemical compound with molecular formula C9H12N2O and molecular weight 164.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-amino-2-methylphenyl)acetamide
Also Known As: N-(5-amino-2-methylphenyl)acetamide, 2-Acetylamino-4-aminotoluene, 5'-Amino-2'-methylacetanilide, 2-Acetylamino-p-toluidine, Acetamide, N-(5-amino-2-methylphenyl)-
| Molecular Formula | C9H12N2O |
|---|---|
| Molecular Weight | 164.09 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 164.09496 |
| Heavy Atoms | 12 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 5434-30-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N)NC(=O)C |
| InChIKey | UAZGSMMESOKKQZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Acetylamino-4-aminotoluene (CAS 5434-30-0), with molecular formula C9H12N2O and molecular weight 164.09 g/mol. IUPAC: N-(5-amino-2-methylphenyl)acetamide.
Chemical Property Profile of 2-Acetylamino-4-aminotoluene
Property Insights of 2-Acetylamino-4-aminotoluene
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Acetylamino-4-aminotoluene. With a topological polar surface area (TPSA) of 55.1 Ų, 2-Acetylamino-4-aminotoluene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Acetylamino-4-aminotoluene has 2 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-Acetylamino-4-aminotoluene?
The CAS number of 2-Acetylamino-4-aminotoluene is 5434-30-0.
What is the molecular formula of 2-Acetylamino-4-aminotoluene?
The molecular formula of 2-Acetylamino-4-aminotoluene is C9H12N2O.
What is the molecular weight of 2-Acetylamino-4-aminotoluene?
The molecular weight of 2-Acetylamino-4-aminotoluene is 164.09 g/mol.
Where can I buy 2-Acetylamino-4-aminotoluene?
You can request a quote for 2-Acetylamino-4-aminotoluene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetylamino-4-aminotoluene?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetylamino-4-aminotoluene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.