5-nitro-2-(1H-pyrrol-1-yl)phenol
TL;DR: 5-nitro-2-(1H-pyrrol-1-yl)phenol (CAS 106981-64-0) is a chemical compound with molecular formula C10H8N2O3 and molecular weight 204.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-2-pyrrol-1-ylphenol
Also Known As: 5-nitro-2-(1H-pyrrol-1-yl)phenol, 5-nitro-2-pyrrol-1-ylphenol, 5-nitro-2-pyrrolylphenol, Phenol, 5-nitro-2-(1H-pyrrol-1-yl)-, 5-nitro-2-pyrrol-1-yl-phenol
| Molecular Formula | C10H8N2O3 |
|---|---|
| Molecular Weight | 204.05 g/mol |
| LogP | 2.0911 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.0535 |
| Heavy Atoms | 15 |
| Complexity | 491.37354 |
Chemical Identifiers
| CAS Number | 106981-64-0 |
|---|---|
| SMILES | C1=CN(C=C1)C2=C(C=C(C=C2)[N+](=O)[O-])O |
Product Overview
5-nitro-2-(1H-pyrrol-1-yl)phenol (CAS 106981-64-0), with molecular formula C10H8N2O3 and molecular weight 204.05 g/mol. IUPAC: 5-nitro-2-pyrrol-1-ylphenol.
Chemical Property Profile of 5-nitro-2-(1H-pyrrol-1-yl)phenol
Property Insights of 5-nitro-2-(1H-pyrrol-1-yl)phenol
The XLogP value of 2.0911 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-nitro-2-(1H-pyrrol-1-yl)phenol. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-nitro-2-(1H-pyrrol-1-yl)phenol. Following Lipinski's Rule of Five, 5-nitro-2-(1H-pyrrol-1-yl)phenol has 1 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 5-nitro-2-(1H-pyrrol-1-yl)phenol?
The CAS number of 5-nitro-2-(1H-pyrrol-1-yl)phenol is 106981-64-0.
What is the molecular formula of 5-nitro-2-(1H-pyrrol-1-yl)phenol?
The molecular formula of 5-nitro-2-(1H-pyrrol-1-yl)phenol is C10H8N2O3.
What is the molecular weight of 5-nitro-2-(1H-pyrrol-1-yl)phenol?
The molecular weight of 5-nitro-2-(1H-pyrrol-1-yl)phenol is 204.05 g/mol.
Where can I buy 5-nitro-2-(1H-pyrrol-1-yl)phenol?
You can request a quote for 5-nitro-2-(1H-pyrrol-1-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-nitro-2-(1H-pyrrol-1-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 5-nitro-2-(1H-pyrrol-1-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.