1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3)
TL;DR: 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3) (CAS 49721-50-8) is a chemical compound with molecular formula C14H47N6O12P3 and molecular weight 584.24646 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(4-azaniumylbutyl(3-azaniumylpropyl)azanium);hydrogen phosphate
Also Known As: Spermidine phosphate, SPD phosphate, CYTISINE NITRATE, Dispermidine triphosphate, 1,4-BUTANEDIAMINE, N-(3-AMINOPROPYL)-, PHOSPHATE (2:3)
Technical Specifications
| Molecular Formula | C14H47N6O12P3 |
| Molecular Weight | 584.24646 g/mol |
| XLogP | -12.17 |
| Topological Polar Surface Area (TPSA) | 394.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 14 |
| Exact Mass | 584.24646 Da |
| Heavy Atoms | 35 |
| Complexity | 103.0 |
| SMILES | C(CC[NH2+]CCC[NH3+])C[NH3+].C(CC[NH2+]CCC[NH3+])C[NH3+].OP(=O)([O-])[O-].OP(=O)([O-])[O-].OP(=O)([O-])[O-] |
| InChIKey | RQFVSMCFDFGRDX-UHFFFAOYSA-N |
Chemical Property Profile of 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3)
Property Insights of 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3)
The XLogP value of -12.17 indicates that 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 394.0 Ų indicates high polarity, suggesting 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3) has 9 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3)?
The CAS number of 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3) is 49721-50-8.
What is the molecular formula of 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3)?
The molecular formula of 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3) is C14H47N6O12P3.
What is the molecular weight of 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3)?
The molecular weight of 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3) is 584.24646 g/mol.
Where can I buy 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3)?
You can request a quote for 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3)?
Yes, CoreyChem provides custom synthesis services for 1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.