(4,6-Dimethylpyridin-2-yl)methyl acetate
TL;DR: (4,6-Dimethylpyridin-2-yl)methyl acetate (CAS 20609-14-7) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4,6-dimethyl-2-pyridinyl)methyl acetate
Also Known As: (4,6-dimethylpyridin-2-yl)methyl acetate, 2-acetoxymethyl-4,6-dimethylpyridine, (4,6-Dimethyl-2-pyridinyl)methyl acetate, (4,6-dimethylpyridin-2-yl)methylacetate, (4,6-Dimethyl-2-pyridinyl)methyl acetate #
| Molecular Formula | C10H13NO2 |
|---|---|
| Molecular Weight | 179.09 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 179.09464 |
| Heavy Atoms | 13 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 20609-14-7 |
|---|---|
| SMILES | CC1=CC(=NC(=C1)COC(=O)C)C |
| InChIKey | TVAQTQAOIWOVLS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(4,6-Dimethylpyridin-2-yl)methyl acetate (CAS 20609-14-7), with molecular formula C10H13NO2 and molecular weight 179.09 g/mol. IUPAC: (4,6-dimethyl-2-pyridinyl)methyl acetate.
Chemical Property Profile of (4,6-Dimethylpyridin-2-yl)methyl acetate
Property Insights of (4,6-Dimethylpyridin-2-yl)methyl acetate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4,6-Dimethylpyridin-2-yl)methyl acetate. With a topological polar surface area (TPSA) of 39.2 Ų, (4,6-Dimethylpyridin-2-yl)methyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4,6-Dimethylpyridin-2-yl)methyl acetate has 0 hydrogen bond donor(s) and 3 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 (4,6-Dimethylpyridin-2-yl)methyl acetate?
The CAS number of (4,6-Dimethylpyridin-2-yl)methyl acetate is 20609-14-7.
What is the molecular formula of (4,6-Dimethylpyridin-2-yl)methyl acetate?
The molecular formula of (4,6-Dimethylpyridin-2-yl)methyl acetate is C10H13NO2.
What is the molecular weight of (4,6-Dimethylpyridin-2-yl)methyl acetate?
The molecular weight of (4,6-Dimethylpyridin-2-yl)methyl acetate is 179.09 g/mol.
Where can I buy (4,6-Dimethylpyridin-2-yl)methyl acetate?
You can request a quote for (4,6-Dimethylpyridin-2-yl)methyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4,6-Dimethylpyridin-2-yl)methyl acetate?
Yes, KEHONG BIO provides custom synthesis services for (4,6-Dimethylpyridin-2-yl)methyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.