3-Pyridinol, 2,4,6-trinitro-
TL;DR: 3-Pyridinol, 2,4,6-trinitro- (CAS 98027-99-7) is a chemical compound with molecular formula C5H2N4O7 and molecular weight 229.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-trinitropyridin-3-ol
Also Known As: 3-Pyridinol, 2,4,6-trinitro-, 2,4,6-trinitropyridin-3-ol, 2,4,6-trinitro-3-pyridinol, 2,4,6-Trinitro-pyridin-3-ol, 3-hydroxy-2,4,6-trinitropyridine
| Molecular Formula | C5H2N4O7 |
|---|---|
| Molecular Weight | 229.99 g/mol |
| LogP | 0.5118 |
| Topological Polar Surface Area | 162.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 229.99236 |
| Heavy Atoms | 16 |
| Complexity | 462.54572 |
Chemical Identifiers
| CAS Number | 98027-99-7 |
|---|---|
| SMILES | C1=C(C(=C(N=C1[N+](=O)[O-])[N+](=O)[O-])O)[N+](=O)[O-] |
Product Overview
3-Pyridinol, 2,4,6-trinitro- (CAS 98027-99-7), with molecular formula C5H2N4O7 and molecular weight 229.99 g/mol. IUPAC: 2,4,6-trinitropyridin-3-ol.
Chemical Property Profile of 3-Pyridinol, 2,4,6-trinitro-
Property Insights of 3-Pyridinol, 2,4,6-trinitro-
The XLogP value of 0.5118 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyridinol, 2,4,6-trinitro-. The TPSA of 162.54 Ų indicates high polarity, suggesting 3-Pyridinol, 2,4,6-trinitro- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-Pyridinol, 2,4,6-trinitro- has 1 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 3-Pyridinol, 2,4,6-trinitro-?
The CAS number of 3-Pyridinol, 2,4,6-trinitro- is 98027-99-7.
What is the molecular formula of 3-Pyridinol, 2,4,6-trinitro-?
The molecular formula of 3-Pyridinol, 2,4,6-trinitro- is C5H2N4O7.
What is the molecular weight of 3-Pyridinol, 2,4,6-trinitro-?
The molecular weight of 3-Pyridinol, 2,4,6-trinitro- is 229.99 g/mol.
Where can I buy 3-Pyridinol, 2,4,6-trinitro-?
You can request a quote for 3-Pyridinol, 2,4,6-trinitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyridinol, 2,4,6-trinitro-?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridinol, 2,4,6-trinitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.