![Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris- structure](/static/products/944/94467-76-2.png)
Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris-
TL;DR: Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris- (CAS 94467-76-2) is a chemical compound with molecular formula C12H18N6O9 and molecular weight 390.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3,5-bis(2-hydroxyethylamino)-2,4,6-trinitroanilino]ethanol
Also Known As: BAS 00068175, 2-[3,5-bis(2-hydroxyethylamino)-2,4,6-trinitroanilino]ethanol, Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris-, 1,3,5-tris(2-hydroxyethylamino)-2,4,6-trinitrobenzene, 2,4,6-trinitro-1,3,5-tris(2-hydroxyethylamino)benzene
| Molecular Formula | C12H18N6O9 |
|---|---|
| Molecular Weight | 390.11 g/mol |
| LogP | -0.3762 |
| Topological Polar Surface Area | 226.2 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 12 |
| Exact Mass | 390.11353 |
| Heavy Atoms | 27 |
| Complexity | 609.5121 |
Chemical Identifiers
| CAS Number | 94467-76-2 |
|---|---|
| SMILES | C(CO)NC1=C(C(=C(C(=C1[N+](=O)[O-])NCCO)[N+](=O)[O-])NCCO)[N+](=O)[O-] |
Product Overview
Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris- (CAS 94467-76-2), with molecular formula C12H18N6O9 and molecular weight 390.11 g/mol. IUPAC: 2-[3,5-bis(2-hydroxyethylamino)-2,4,6-trinitroanilino]ethanol.
Chemical Property Profile of Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris-
Property Insights of Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris-
The XLogP value of -0.3762 indicates that Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 226.2 Ų indicates high polarity, suggesting Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris- has 6 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 Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris-?
The CAS number of Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris- is 94467-76-2.
What is the molecular formula of Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris-?
The molecular formula of Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris- is C12H18N6O9.
What is the molecular weight of Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris-?
The molecular weight of Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris- is 390.11 g/mol.
Where can I buy Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris-?
You can request a quote for Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris-?
Yes, KEHONG BIO provides custom synthesis services for Ethanol, 2,2',2''-[(2,4,6-trinitro-1,3,5-benzenetriyl)triimino]tris- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.