吡啶-4-乙腈
TL;DR: 吡啶-4-乙腈 (CAS 92333-25-0) is a chemical compound with molecular formula C7H6N2 and molecular weight 118.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吡啶-4-乙腈
2-pyridin-4-ylacetonitrile
Also Known As: 4-Pyridylacetonitrile, Pyridin-4-yl-acetonitrile, 4-Pyridineacetonitrile, 2-(PYRIDIN-4-YL)ACETONITRILE, 2-pyridin-4-ylacetonitrile
| Molecular Formula | C7H6N2 |
|---|---|
| Molecular Weight | 118.05 g/mol |
| LogP | 1.14768 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 118.0531 |
| Heavy Atoms | 9 |
| Complexity | 210.1078 |
Chemical Identifiers
| CAS Number | 92333-25-0 |
|---|---|
| SMILES | C1=CN=CC=C1CC#N |
Product Overview
吡啶-4-乙腈 (CAS 92333-25-0), with molecular formula C7H6N2 and molecular weight 118.05 g/mol. IUPAC: 2-pyridin-4-ylacetonitrile.
Chemical Property Profile of 吡啶-4-乙腈
Property Insights of 吡啶-4-乙腈
The XLogP value of 1.14768 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 吡啶-4-乙腈. With a topological polar surface area (TPSA) of 36.68 Ų, 吡啶-4-乙腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 吡啶-4-乙腈 has 0 hydrogen bond donor(s) and 2 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 吡啶-4-乙腈?
The CAS number of 吡啶-4-乙腈 is 92333-25-0.
What is the molecular formula of 吡啶-4-乙腈?
The molecular formula of 吡啶-4-乙腈 is C7H6N2.
What is the molecular weight of 吡啶-4-乙腈?
The molecular weight of 吡啶-4-乙腈 is 118.05 g/mol.
Where can I buy 吡啶-4-乙腈?
You can request a quote for 吡啶-4-乙腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 吡啶-4-乙腈?
Yes, KEHONG BIO provides custom synthesis services for 吡啶-4-乙腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.