Aziridine;2,4,6-trinitrophenol
TL;DR: Aziridine;2,4,6-trinitrophenol (CAS 2439-68-1) is a chemical compound with molecular formula C8H8N4O7 and molecular weight 272.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
aziridine;2,4,6-trinitrophenol
Also Known As: Aziridine, Aziridine;2,4,6-trinitrophenol, aziridine; 2,4,6-trinitrophenol, 2,4,6-trinitrophenol- aziridine(1:1), 2,4,6-Trinitrophenol--aziridine (1/1)
| Molecular Formula | C8H8N4O7 |
|---|---|
| Molecular Weight | 272.04 g/mol |
| LogP | 0.7064 |
| Topological Polar Surface Area | 180.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 272.0393 |
| Heavy Atoms | 19 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 2439-68-1 |
|---|---|
| SMILES | C1CN1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | AHRPNWZLOYKKIH-UHFFFAOYSA-N |
Product Overview
Aziridine;2,4,6-trinitrophenol (CAS 2439-68-1), with molecular formula C8H8N4O7 and molecular weight 272.04 g/mol. IUPAC: aziridine;2,4,6-trinitrophenol.
Chemical Property Profile of Aziridine;2,4,6-trinitrophenol
Property Insights of Aziridine;2,4,6-trinitrophenol
The XLogP value of 0.7064 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aziridine;2,4,6-trinitrophenol. The TPSA of 180.0 Ų indicates high polarity, suggesting Aziridine;2,4,6-trinitrophenol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Aziridine;2,4,6-trinitrophenol has 2 hydrogen bond donor(s) and 8 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 Aziridine;2,4,6-trinitrophenol?
The CAS number of Aziridine;2,4,6-trinitrophenol is 2439-68-1.
What is the molecular formula of Aziridine;2,4,6-trinitrophenol?
The molecular formula of Aziridine;2,4,6-trinitrophenol is C8H8N4O7.
What is the molecular weight of Aziridine;2,4,6-trinitrophenol?
The molecular weight of Aziridine;2,4,6-trinitrophenol is 272.04 g/mol.
Where can I buy Aziridine;2,4,6-trinitrophenol?
You can request a quote for Aziridine;2,4,6-trinitrophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aziridine;2,4,6-trinitrophenol?
Yes, KEHONG BIO provides custom synthesis services for Aziridine;2,4,6-trinitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.