(4-Nitrophenyl)-pyrrol-1-ylmethanone
TL;DR: (4-Nitrophenyl)-pyrrol-1-ylmethanone (CAS 40123-20-4) is a chemical compound with molecular formula C11H8N2O3 and molecular weight 216.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl)-pyrrol-1-ylmethanone
Also Known As: 1-(4-Nitrobenzoyl)-1H-pyrrole, (4-nitrophenyl)-pyrrol-1-ylmethanone, (4-nitrophenyl)(1H-pyrrol-1-yl)methanone, (4-nitrophenyl)-pyrrol-1-yl-methanone, J1.022.817D
| Molecular Formula | C11H8N2O3 |
|---|---|
| Molecular Weight | 216.05 g/mol |
| LogP | 2.0848 |
| Topological Polar Surface Area | 65.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.0535 |
| Heavy Atoms | 16 |
| Complexity | 514.67255 |
Chemical Identifiers
| CAS Number | 40123-20-4 |
|---|---|
| SMILES | C1=CN(C=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
(4-Nitrophenyl)-pyrrol-1-ylmethanone (CAS 40123-20-4), with molecular formula C11H8N2O3 and molecular weight 216.05 g/mol. IUPAC: (4-nitrophenyl)-pyrrol-1-ylmethanone.
Chemical Property Profile of (4-Nitrophenyl)-pyrrol-1-ylmethanone
Property Insights of (4-Nitrophenyl)-pyrrol-1-ylmethanone
The XLogP value of 2.0848 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Nitrophenyl)-pyrrol-1-ylmethanone. The TPSA of 65.14 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Nitrophenyl)-pyrrol-1-ylmethanone. Following Lipinski's Rule of Five, (4-Nitrophenyl)-pyrrol-1-ylmethanone 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 (4-Nitrophenyl)-pyrrol-1-ylmethanone?
The CAS number of (4-Nitrophenyl)-pyrrol-1-ylmethanone is 40123-20-4.
What is the molecular formula of (4-Nitrophenyl)-pyrrol-1-ylmethanone?
The molecular formula of (4-Nitrophenyl)-pyrrol-1-ylmethanone is C11H8N2O3.
What is the molecular weight of (4-Nitrophenyl)-pyrrol-1-ylmethanone?
The molecular weight of (4-Nitrophenyl)-pyrrol-1-ylmethanone is 216.05 g/mol.
Where can I buy (4-Nitrophenyl)-pyrrol-1-ylmethanone?
You can request a quote for (4-Nitrophenyl)-pyrrol-1-ylmethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Nitrophenyl)-pyrrol-1-ylmethanone?
Yes, KEHONG BIO provides custom synthesis services for (4-Nitrophenyl)-pyrrol-1-ylmethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.