3-吡啶乙酸
TL;DR: 3-吡啶乙酸 (CAS 501-81-5) is a chemical compound with molecular formula C7H7NO2 and molecular weight 137.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-吡啶乙酸
2-pyridin-3-ylacetic acid
Also Known As: 3-pyridineacetic acid, 3-pyridylacetic acid, lioxone, minedil, Piristerol
| Molecular Formula | C7H7NO2 |
|---|---|
| Molecular Weight | 137.05 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 137.04768 |
| Heavy Atoms | 10 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 501-81-5 |
|---|---|
| SMILES | C1=CC(=CN=C1)CC(=O)O |
| InChIKey | WGNUNYPERJMVRM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-吡啶乙酸 (CAS 501-81-5), with molecular formula C7H7NO2 and molecular weight 137.05 g/mol. IUPAC: 2-pyridin-3-ylacetic acid.
Chemical Property Profile of 3-吡啶乙酸
Property Insights of 3-吡啶乙酸
The XLogP value of -0.1 indicates that 3-吡啶乙酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 50.2 Ų, 3-吡啶乙酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-吡啶乙酸 has 1 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-吡啶乙酸?
The CAS number of 3-吡啶乙酸 is 501-81-5.
What is the molecular formula of 3-吡啶乙酸?
The molecular formula of 3-吡啶乙酸 is C7H7NO2.
What is the molecular weight of 3-吡啶乙酸?
The molecular weight of 3-吡啶乙酸 is 137.05 g/mol.
Where can I buy 3-吡啶乙酸?
You can request a quote for 3-吡啶乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-吡啶乙酸?
Yes, KEHONG BIO provides custom synthesis services for 3-吡啶乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.