1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid
TL;DR: 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid (CAS 114990-15-7) is a chemical compound with molecular formula C5H10N3O3P and molecular weight 191.04597 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1-amino-2-(1H-imidazol-5-yl)ethyl]phosphonic acid
Also Known As: Aiyepa, [1-amino-2-(1h-imidazol-5-yl)ethyl]phosphonic acid, KST-1A2407, 1-Amino-2-imidazol-4'-ylethylphosphonic acid, 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid
Technical Specifications
| Molecular Formula | C5H10N3O3P |
| Molecular Weight | 191.04597 g/mol |
| XLogP | -4.5 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 191.04597 Da |
| Heavy Atoms | 12 |
| Complexity | 194.0 |
| SMILES | C1=C(NC=N1)CC(N)P(=O)(O)O |
| InChIKey | RBWBYDGLCQQGRQ-UHFFFAOYSA-N |
Chemical Property Profile of 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid
Property Insights of 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid
The XLogP value of -4.5 indicates that 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid. Following Lipinski's Rule of Five, 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid?
The CAS number of 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid is 114990-15-7.
What is the molecular formula of 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid?
The molecular formula of 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid is C5H10N3O3P.
What is the molecular weight of 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid?
The molecular weight of 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid is 191.04597 g/mol.
Where can I buy 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid?
You can request a quote for 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid?
Yes, CoreyChem provides custom synthesis services for 1-Amino-2-(imidazol-4'-yl)ethylphosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.