3-Pyridylacetate
TL;DR: 3-Pyridylacetate (CAS 6419-36-9) is a chemical compound with molecular formula C7H6NO2- and molecular weight 136.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyridin-3-ylacetate
Also Known As: coletin, lessterol, lioxone, minedil, piridil
| Molecular Formula | C7H6NO2- |
|---|---|
| Molecular Weight | 136.04 g/mol |
| LogP | -0.626 |
| Topological Polar Surface Area | 53.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 136.03986 |
| Heavy Atoms | 10 |
| Complexity | 220.30753 |
Chemical Identifiers
| CAS Number | 6419-36-9 |
|---|---|
| SMILES | C1=CC(=CN=C1)CC(=O)[O-] |
Product Overview
3-Pyridylacetate (CAS 6419-36-9), with molecular formula C7H6NO2- and molecular weight 136.04 g/mol. IUPAC: 2-pyridin-3-ylacetate.
Chemical Property Profile of 3-Pyridylacetate
Property Insights of 3-Pyridylacetate
The XLogP value of -0.626 indicates that 3-Pyridylacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 53.02 Ų, 3-Pyridylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pyridylacetate 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 3-Pyridylacetate?
The CAS number of 3-Pyridylacetate is 6419-36-9.
What is the molecular formula of 3-Pyridylacetate?
The molecular formula of 3-Pyridylacetate is C7H6NO2-.
What is the molecular weight of 3-Pyridylacetate?
The molecular weight of 3-Pyridylacetate is 136.04 g/mol.
Where can I buy 3-Pyridylacetate?
You can request a quote for 3-Pyridylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyridylacetate?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.