![Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate structure](/static/products/453/4532-21-2.png)
Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate
TL;DR: Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate (CAS 4532-21-2) is a chemical compound with molecular formula C3H18N3O9P3 and molecular weight 333.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diazanium;[phosphonatomethyl(phosphonomethyl)amino]methylphosphonic acid
Also Known As: EINECS 224-869-2, Diammonium tetrahydrogen (nitrilotris(methylene))trisphosphonate, Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate, diammoniumtetrahydrogen[nitrilotris ]trisphosphonate, Diammonium {[bis(phosphonomethyl)amino]methyl}phosphonate
| Molecular Formula | C3H18N3O9P3 |
|---|---|
| Molecular Weight | 333.03 g/mol |
| LogP | -1.8176 |
| Topological Polar Surface Area | 254.49 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 333.0256 |
| Heavy Atoms | 18 |
| Complexity | 311.4406 |
Chemical Identifiers
| CAS Number | 4532-21-2 |
|---|---|
| SMILES | C(N(CP(=O)(O)O)CP(=O)([O-])[O-])P(=O)(O)O.[NH4+].[NH4+] |
Product Overview
Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate (CAS 4532-21-2), with molecular formula C3H18N3O9P3 and molecular weight 333.03 g/mol. IUPAC: diazanium;[phosphonatomethyl(phosphonomethyl)amino]methylphosphonic acid.
Chemical Property Profile of Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate
Property Insights of Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate
The XLogP value of -1.8176 indicates that Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 254.49 Ų indicates high polarity, suggesting Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate?
The CAS number of Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate is 4532-21-2.
What is the molecular formula of Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate?
The molecular formula of Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate is C3H18N3O9P3.
What is the molecular weight of Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate?
The molecular weight of Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate is 333.03 g/mol.
Where can I buy Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate?
You can request a quote for Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diammonium tetrahydrogen [nitrilotris(methylene)]trisphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.