C9H28N3O15P5.xH3N
TL;DR: C9H28N3O15P5.xH3N (CAS 70714-66-8) is a chemical compound with molecular formula C9H31N4O15P5 and molecular weight 590.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azane;[bis[2-[bis(phosphonomethyl)amino]ethyl]amino]methylphosphonic acid
Also Known As: KST-1A7942, EC 274-798-6, Diethylenetriaminepenta(methylenephosphonic) acid, [(bis{2-[bis(phosphonomethyl)amino]ethyl}amino)methyl]phosphonic acid ammoniate(1:1), azane; [bis[2-[bis(phosphonomethyl)amino]ethyl]amino]methylphosphonic acid
| Molecular Formula | C9H31N4O15P5 |
|---|---|
| Molecular Weight | 590.05 g/mol |
| LogP | -2.27 |
| Topological Polar Surface Area | 298.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 16 |
| Exact Mass | 590.0474 |
| Heavy Atoms | 33 |
| Complexity | 720.0 |
Chemical Identifiers
| CAS Number | 70714-66-8 |
|---|---|
| SMILES | C(CN(CP(=O)(O)O)CP(=O)(O)O)N(CCN(CP(=O)(O)O)CP(=O)(O)O)CP(=O)(O)O.N |
| InChIKey | WVGVLUWJNYWIEC-UHFFFAOYSA-N |
Product Overview
C9H28N3O15P5.xH3N (CAS 70714-66-8), with molecular formula C9H31N4O15P5 and molecular weight 590.05 g/mol. IUPAC: azane;[bis[2-[bis(phosphonomethyl)amino]ethyl]amino]methylphosphonic acid.
Chemical Property Profile of C9H28N3O15P5.xH3N
Property Insights of C9H28N3O15P5.xH3N
The XLogP value of -2.27 indicates that C9H28N3O15P5.xH3N is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 298.0 Ų indicates high polarity, suggesting C9H28N3O15P5.xH3N may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C9H28N3O15P5.xH3N has 11 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C9H28N3O15P5.xH3N?
The CAS number of C9H28N3O15P5.xH3N is 70714-66-8.
What is the molecular formula of C9H28N3O15P5.xH3N?
The molecular formula of C9H28N3O15P5.xH3N is C9H31N4O15P5.
What is the molecular weight of C9H28N3O15P5.xH3N?
The molecular weight of C9H28N3O15P5.xH3N is 590.05 g/mol.
Where can I buy C9H28N3O15P5.xH3N?
You can request a quote for C9H28N3O15P5.xH3N directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C9H28N3O15P5.xH3N?
Yes, KEHONG BIO provides custom synthesis services for C9H28N3O15P5.xH3N and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.