Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5)
TL;DR: Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5) (CAS 63717-30-6) is a chemical compound with molecular formula C12H44N4O11P2S2 and molecular weight 546.1923 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(3-(3-aminopropylamino)propylsulfanylphosphonic acid);pentahydrate
Also Known As: Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5), S-2-((3-Aminopropyl)amino)propyl dihydrogen phosphorothioate hydrate (2:2:5), Phosphorothioic acid, S-ester with 2-((3-aminopropyl)amino)propanethiol, hydrate (2:2:5), Propanethiol, 2-((3-aminopropyl)amino)-, dihydrogen phosphate (ester) hydrate (2:2:5), 3-(3-aminopropylamino)propylsulfanylphosphonic acid pentahydrate
Technical Specifications
| Molecular Formula | C12H44N4O11P2S2 |
| Molecular Weight | 546.1923 g/mol |
| XLogP | -3.84 |
| Topological Polar Surface Area (TPSA) | 247.0 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 16 |
| Exact Mass | 546.1923 Da |
| Heavy Atoms | 31 |
| Complexity | 164.0 |
| SMILES | C(CN)CNCCCSP(=O)(O)O.C(CN)CNCCCSP(=O)(O)O.O.O.O.O.O |
| InChIKey | YXYJKSUNCFFNLM-UHFFFAOYSA-N |
Chemical Property Profile of Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5)
Property Insights of Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5)
The XLogP value of -3.84 indicates that Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 247.0 Ų indicates high polarity, suggesting Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5) has 13 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5)?
The CAS number of Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5) is 63717-30-6.
What is the molecular formula of Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5)?
The molecular formula of Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5) is C12H44N4O11P2S2.
What is the molecular weight of Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5)?
The molecular weight of Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5) is 546.1923 g/mol.
Where can I buy Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5)?
You can request a quote for Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5)?
Yes, CoreyChem provides custom synthesis services for Phosphorothioic acid, S-(2-((3-aminopropyl)amino)propyl) ester, hydrate (2:2:5) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.