Melammonium pentate
TL;DR: Melammonium pentate (CAS 70776-17-9) is a chemical compound with molecular formula C11H22N12O8P2 and molecular weight 512.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,9-dihydroxy-2,4,8,10-tetraoxa-3λ5,9λ5-diphosphaspiro[5.5]undecane 3,9-dioxide;bis(1,3,5-triazine-2,4,6-triamine)
Also Known As: Melammonium pentate, Bis-melaminium pentate, Incindex XP 1699, Pentaerythritiol bisphosphorate, XP 1495
| Molecular Formula | C11H22N12O8P2 |
|---|---|
| Molecular Weight | 512.12 g/mol |
| LogP | -2.4964 |
| Topological Polar Surface Area | 345.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 0 |
| Exact Mass | 512.1159 |
| Heavy Atoms | 33 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 70776-17-9 |
|---|---|
| SMILES | C1C2(COP(=O)(O1)O)COP(=O)(OC2)O.C1(=NC(=NC(=N1)N)N)N.C1(=NC(=NC(=N1)N)N)N |
| InChIKey | JCDRSDQQFZMLMN-UHFFFAOYSA-N |
Product Overview
Melammonium pentate (CAS 70776-17-9), with molecular formula C11H22N12O8P2 and molecular weight 512.12 g/mol. IUPAC: 3,9-dihydroxy-2,4,8,10-tetraoxa-3λ5,9λ5-diphosphaspiro[5.5]undecane 3,9-dioxide;bis(1,3,5-triazine-2,4,6-triamine).
Chemical Property Profile of Melammonium pentate
Property Insights of Melammonium pentate
The XLogP value of -2.4964 indicates that Melammonium pentate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 345.0 Ų indicates high polarity, suggesting Melammonium pentate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Melammonium pentate has 8 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Melammonium pentate?
The CAS number of Melammonium pentate is 70776-17-9.
What is the molecular formula of Melammonium pentate?
The molecular formula of Melammonium pentate is C11H22N12O8P2.
What is the molecular weight of Melammonium pentate?
The molecular weight of Melammonium pentate is 512.12 g/mol.
Where can I buy Melammonium pentate?
You can request a quote for Melammonium pentate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Melammonium pentate?
Yes, KEHONG BIO provides custom synthesis services for Melammonium pentate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.