3',4'-Dimethylacetanilide
TL;DR: 3',4'-Dimethylacetanilide (CAS 2198-54-1) 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.
N-(3,4-dimethylphenyl)acetamide
Also Known As: N-(3,4-Dimethylphenyl)acetamide, 3',4'-Dimethylacetanilide, 3,4-Dimethylacetanilide, N-Acetyl-3,4-xylidine, 3',4'-Acetoxylidide
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 2198-54-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)C)C |
| InChIKey | UAOIEEWQVAXCFY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3',4'-Dimethylacetanilide (CAS 2198-54-1), with molecular formula C10H13NO and molecular weight 163.10 g/mol. IUPAC: N-(3,4-dimethylphenyl)acetamide.
Chemical Property Profile of 3',4'-Dimethylacetanilide
Property Insights of 3',4'-Dimethylacetanilide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3',4'-Dimethylacetanilide. With a topological polar surface area (TPSA) of 29.1 Ų, 3',4'-Dimethylacetanilide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3',4'-Dimethylacetanilide 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 3',4'-Dimethylacetanilide?
The CAS number of 3',4'-Dimethylacetanilide is 2198-54-1.
What is the molecular formula of 3',4'-Dimethylacetanilide?
The molecular formula of 3',4'-Dimethylacetanilide is C10H13NO.
What is the molecular weight of 3',4'-Dimethylacetanilide?
The molecular weight of 3',4'-Dimethylacetanilide is 163.10 g/mol.
Where can I buy 3',4'-Dimethylacetanilide?
You can request a quote for 3',4'-Dimethylacetanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3',4'-Dimethylacetanilide?
Yes, KEHONG BIO provides custom synthesis services for 3',4'-Dimethylacetanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.