Pyridin-2-yl 3-methylbenzoate
TL;DR: Pyridin-2-yl 3-methylbenzoate (CAS 73686-47-2) is a chemical compound with molecular formula C13H11NO2 and molecular weight 213.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyridin-2-yl 3-methylbenzoate
Also Known As: pyridin-2-yl 3-methylbenzoate, AO-854/40702759
| Molecular Formula | C13H11NO2 |
|---|---|
| Molecular Weight | 213.08 g/mol |
| LogP | 2.60922 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 213.07898 |
| Heavy Atoms | 16 |
| Complexity | 494.2956 |
Chemical Identifiers
| CAS Number | 73686-47-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)OC2=CC=CC=N2 |
Product Overview
Pyridin-2-yl 3-methylbenzoate (CAS 73686-47-2), with molecular formula C13H11NO2 and molecular weight 213.08 g/mol. IUPAC: pyridin-2-yl 3-methylbenzoate.
Chemical Property Profile of Pyridin-2-yl 3-methylbenzoate
Property Insights of Pyridin-2-yl 3-methylbenzoate
The XLogP value of 2.60922 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridin-2-yl 3-methylbenzoate. With a topological polar surface area (TPSA) of 39.19 Ų, Pyridin-2-yl 3-methylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridin-2-yl 3-methylbenzoate 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 Pyridin-2-yl 3-methylbenzoate?
The CAS number of Pyridin-2-yl 3-methylbenzoate is 73686-47-2.
What is the molecular formula of Pyridin-2-yl 3-methylbenzoate?
The molecular formula of Pyridin-2-yl 3-methylbenzoate is C13H11NO2.
What is the molecular weight of Pyridin-2-yl 3-methylbenzoate?
The molecular weight of Pyridin-2-yl 3-methylbenzoate is 213.08 g/mol.
Where can I buy Pyridin-2-yl 3-methylbenzoate?
You can request a quote for Pyridin-2-yl 3-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridin-2-yl 3-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Pyridin-2-yl 3-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.