2,6-Diethylacetanilide
TL;DR: 2,6-Diethylacetanilide (CAS 16665-89-7) is a chemical compound with molecular formula C12H17NO and molecular weight 191.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,6-diethylphenyl)acetamide
Also Known As: N-(2,6-Diethylphenyl)acetamide, 2,6-Diethylacetanilide, 2',6'-Diethylacetanilide, Acetanilide, 2',6'-diethyl-, N-Acetyl-2,6-diethylaniline
| Molecular Formula | C12H17NO |
|---|---|
| Molecular Weight | 191.13 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 191.13101 |
| Heavy Atoms | 14 |
| Complexity | 179.0 |
| Melting Point | 141 - 142 °C |
Chemical Identifiers
| CAS Number | 16665-89-7 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)CC)NC(=O)C |
| InChIKey | SNPZDXACCGIJNK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-Diethylacetanilide (CAS 16665-89-7), with molecular formula C12H17NO and molecular weight 191.13 g/mol. IUPAC: N-(2,6-diethylphenyl)acetamide.
Chemical Property Profile of 2,6-Diethylacetanilide
Property Insights of 2,6-Diethylacetanilide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Diethylacetanilide. With a topological polar surface area (TPSA) of 29.1 Ų, 2,6-Diethylacetanilide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Diethylacetanilide 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 2,6-Diethylacetanilide?
The CAS number of 2,6-Diethylacetanilide is 16665-89-7.
What is the molecular formula of 2,6-Diethylacetanilide?
The molecular formula of 2,6-Diethylacetanilide is C12H17NO.
What is the molecular weight of 2,6-Diethylacetanilide?
The molecular weight of 2,6-Diethylacetanilide is 191.13 g/mol.
Where can I buy 2,6-Diethylacetanilide?
You can request a quote for 2,6-Diethylacetanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Diethylacetanilide?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Diethylacetanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.