(E)-2-(2-Nitroethenyl)thiophene
TL;DR: (E)-2-(2-Nitroethenyl)thiophene (CAS 874-84-0) is a chemical compound with molecular formula C6H5NO2S and molecular weight 155.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-nitroethenyl)thiophene
Also Known As: 2-(2-Nitrovinyl)thiophene, (E)-2-(2-Nitroethenyl)thiophene, 2-(2-Nitroethenyl)thiophene, nitrovinylthiophene, 2-[(E)-2-Nitrovinyl]thiophene
| Molecular Formula | C6H5NO2S |
|---|---|
| Molecular Weight | 155.00 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 74.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 155.0041 |
| Heavy Atoms | 10 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 874-84-0 |
|---|---|
| SMILES | C1=CSC(=C1)C=C[N+](=O)[O-] |
| InChIKey | UTPOWFFIBWOQRK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(E)-2-(2-Nitroethenyl)thiophene (CAS 874-84-0), with molecular formula C6H5NO2S and molecular weight 155.00 g/mol. IUPAC: 2-(2-nitroethenyl)thiophene.
Chemical Property Profile of (E)-2-(2-Nitroethenyl)thiophene
Property Insights of (E)-2-(2-Nitroethenyl)thiophene
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-(2-Nitroethenyl)thiophene. The TPSA of 74.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(2-Nitroethenyl)thiophene. Following Lipinski's Rule of Five, (E)-2-(2-Nitroethenyl)thiophene 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 (E)-2-(2-Nitroethenyl)thiophene?
The CAS number of (E)-2-(2-Nitroethenyl)thiophene is 874-84-0.
What is the molecular formula of (E)-2-(2-Nitroethenyl)thiophene?
The molecular formula of (E)-2-(2-Nitroethenyl)thiophene is C6H5NO2S.
What is the molecular weight of (E)-2-(2-Nitroethenyl)thiophene?
The molecular weight of (E)-2-(2-Nitroethenyl)thiophene is 155.00 g/mol.
Where can I buy (E)-2-(2-Nitroethenyl)thiophene?
You can request a quote for (E)-2-(2-Nitroethenyl)thiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(2-Nitroethenyl)thiophene?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(2-Nitroethenyl)thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.