3-Benzylpyridine
TL;DR: 3-Benzylpyridine (CAS 620-95-1) is a chemical compound with molecular formula C12H11N and molecular weight 169.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzylpyridine
Also Known As: 3-BENZYLPYRIDINE, 3-benzyl-pyridine, Pyridine, 3-(phenylmethyl)-, 3-(Benzyl)pyridine, 3-benzyl pyridine
| Molecular Formula | C12H11N |
|---|---|
| Molecular Weight | 169.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 169.08914 |
| Heavy Atoms | 13 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 620-95-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=CN=CC=C2 |
| InChIKey | UUCLVSDUMKMBSM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Benzylpyridine (CAS 620-95-1), with molecular formula C12H11N and molecular weight 169.09 g/mol. IUPAC: 3-benzylpyridine.
Chemical Property Profile of 3-Benzylpyridine
Property Insights of 3-Benzylpyridine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Benzylpyridine. With a topological polar surface area (TPSA) of 12.9 Ų, 3-Benzylpyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzylpyridine has 0 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 3-Benzylpyridine?
The CAS number of 3-Benzylpyridine is 620-95-1.
What is the molecular formula of 3-Benzylpyridine?
The molecular formula of 3-Benzylpyridine is C12H11N.
What is the molecular weight of 3-Benzylpyridine?
The molecular weight of 3-Benzylpyridine is 169.09 g/mol.
Where can I buy 3-Benzylpyridine?
You can request a quote for 3-Benzylpyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzylpyridine?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzylpyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.