Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-
TL;DR: Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]- (CAS 58754-18-0) is a chemical compound with molecular formula C14H10N2O4 and molecular weight 270.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]pyridine
Also Known As: 2-(4,5-Methylenedioxy-2-nitrostyryl)pyridine, Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]pyridine, 2-[2-(6-Nitro-2H-1,3-benzodioxol-5-yl)ethen-1-yl]pyridine
| Molecular Formula | C14H10N2O4 |
|---|---|
| Molecular Weight | 270.06 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 77.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.06406 |
| Heavy Atoms | 20 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 58754-18-0 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)C=CC3=CC=CC=N3)[N+](=O)[O-] |
| InChIKey | CFLIAJWQICIFDF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]- (CAS 58754-18-0), with molecular formula C14H10N2O4 and molecular weight 270.06 g/mol. IUPAC: 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]pyridine.
Chemical Property Profile of Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-
Property Insights of Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-. The TPSA of 77.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-. Following Lipinski's Rule of Five, Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]- has 0 hydrogen bond donor(s) and 5 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 Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-?
The CAS number of Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]- is 58754-18-0.
What is the molecular formula of Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-?
The molecular formula of Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]- is C14H10N2O4.
What is the molecular weight of Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-?
The molecular weight of Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]- is 270.06 g/mol.
Where can I buy Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-?
You can request a quote for Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-?
Yes, KEHONG BIO provides custom synthesis services for Pyridine, 2-[2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.