Erythrityl Tetranitrate
TL;DR: Erythrityl Tetranitrate (CAS 643-97-0) is a chemical compound with molecular formula C4H6N4O12 and molecular weight 302.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S)-1,3,4-trinitrooxybutan-2-yl] nitrate
Also Known As: Nitroerythrol, ERYTHRITYL TETRANITRATE, Tetranitrol, Erythritol tetranitrate, Tetranitrin
| Molecular Formula | C4H6N4O12 |
|---|---|
| Molecular Weight | 302.00 g/mol |
| LogP | -1.4432 |
| Topological Polar Surface Area | 209.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 11 |
| Exact Mass | 301.99823 |
| Heavy Atoms | 20 |
| Complexity | 347.65363 |
Chemical Identifiers
| CAS Number | 643-97-0 |
|---|---|
| SMILES | C([C@H]([C@H](CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-] |
Product Overview
Erythrityl Tetranitrate (CAS 643-97-0), with molecular formula C4H6N4O12 and molecular weight 302.00 g/mol. IUPAC: [(2R,3S)-1,3,4-trinitrooxybutan-2-yl] nitrate.
Chemical Property Profile of Erythrityl Tetranitrate
Property Insights of Erythrityl Tetranitrate
The XLogP value of -1.4432 indicates that Erythrityl Tetranitrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 209.48 Ų indicates high polarity, suggesting Erythrityl Tetranitrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Erythrityl Tetranitrate has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Erythrityl Tetranitrate?
The CAS number of Erythrityl Tetranitrate is 643-97-0.
What is the molecular formula of Erythrityl Tetranitrate?
The molecular formula of Erythrityl Tetranitrate is C4H6N4O12.
What is the molecular weight of Erythrityl Tetranitrate?
The molecular weight of Erythrityl Tetranitrate is 302.00 g/mol.
Where can I buy Erythrityl Tetranitrate?
You can request a quote for Erythrityl Tetranitrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Erythrityl Tetranitrate?
Yes, KEHONG BIO provides custom synthesis services for Erythrityl Tetranitrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.