Nitrofungin
TL;DR: Nitrofungin (CAS 619-08-9) is a chemical compound with molecular formula C6H4ClNO3 and molecular weight 172.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4-nitrophenol
Also Known As: 2-CHLORO-4-NITROPHENOL, Nitrofungin, Nitrofurgin, Phenol, 2-chloro-4-nitro-, chloronitrophenol
| Molecular Formula | C6H4ClNO3 |
|---|---|
| Molecular Weight | 172.99 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 172.98798 |
| Heavy Atoms | 11 |
| Complexity | 158.0 |
| Melting Point | 111 °C |
| Vapor Pressure | 0.000296 [mmHg] |
Chemical Identifiers
| CAS Number | 619-08-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])Cl)O |
| InChIKey | BOFRXDMCQRTGII-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nitrofungin (CAS 619-08-9), with molecular formula C6H4ClNO3 and molecular weight 172.99 g/mol. IUPAC: 2-chloro-4-nitrophenol.
Chemical Property Profile of Nitrofungin
Property Insights of Nitrofungin
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nitrofungin. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Nitrofungin. Following Lipinski's Rule of Five, Nitrofungin 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 Nitrofungin?
The CAS number of Nitrofungin is 619-08-9.
What is the molecular formula of Nitrofungin?
The molecular formula of Nitrofungin is C6H4ClNO3.
What is the molecular weight of Nitrofungin?
The molecular weight of Nitrofungin is 172.99 g/mol.
Where can I buy Nitrofungin?
You can request a quote for Nitrofungin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nitrofungin?
Yes, KEHONG BIO provides custom synthesis services for Nitrofungin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.