1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)-
TL;DR: 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)- (CAS 593273-65-5) is a chemical compound with molecular formula C12H9FN2O2 and molecular weight 232.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-2-(2-nitroethenyl)pyrrole
Also Known As: 1-(4-fluorophenyl)-2-(2-nitroethenyl)pyrrole, 1H-PYRROLE, 1-(4-FLUOROPHENYL)-2-(2-NITROETHENYL)-, 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)- (9CI)
| Molecular Formula | C12H9FN2O2 |
|---|---|
| Molecular Weight | 232.06 g/mol |
| LogP | 2.8638 |
| Topological Polar Surface Area | 48.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.0648 |
| Heavy Atoms | 17 |
| Complexity | 558.1395 |
Chemical Identifiers
| CAS Number | 593273-65-5 |
|---|---|
| SMILES | C1=CN(C(=C1)C=C[N+](=O)[O-])C2=CC=C(C=C2)F |
Product Overview
1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)- (CAS 593273-65-5), with molecular formula C12H9FN2O2 and molecular weight 232.06 g/mol. IUPAC: 1-(4-fluorophenyl)-2-(2-nitroethenyl)pyrrole.
Chemical Property Profile of 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)-
Property Insights of 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)-
The XLogP value of 2.8638 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)-. With a topological polar surface area (TPSA) of 48.07 Ų, 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)- 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 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)-?
The CAS number of 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)- is 593273-65-5.
What is the molecular formula of 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)-?
The molecular formula of 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)- is C12H9FN2O2.
What is the molecular weight of 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)-?
The molecular weight of 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)- is 232.06 g/mol.
Where can I buy 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)-?
You can request a quote for 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrrole, 1-(4-fluorophenyl)-2-(2-nitroethenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.