3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid
TL;DR: 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid (CAS 138738-21-3) is a chemical compound with molecular formula C8H14NO6P and molecular weight 251.05588 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-phosphonoacetyl)piperidine-2-carboxylic acid
Also Known As: Mdl 100925, Mdl 100,925, 3-(2-phosphonoacetyl)piperidine-2-carboxylic acid, MDL-100,925, 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H14NO6P |
| Molecular Weight | 251.05588 g/mol |
| XLogP | -4.5 |
| Topological Polar Surface Area (TPSA) | 124.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.05588 Da |
| Heavy Atoms | 16 |
| Complexity | 337.0 |
| SMILES | C1CC(C(NC1)C(=O)O)C(=O)CP(=O)(O)O |
| InChIKey | YEEABICQMLEYCN-UHFFFAOYSA-N |
Chemical Property Profile of 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid
Property Insights of 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid
The XLogP value of -4.5 indicates that 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid. Following Lipinski's Rule of Five, 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid?
The CAS number of 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid is 138738-21-3.
What is the molecular formula of 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid?
The molecular formula of 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid is C8H14NO6P.
What is the molecular weight of 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid?
The molecular weight of 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid is 251.05588 g/mol.
Where can I buy 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid?
You can request a quote for 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid?
Yes, CoreyChem provides custom synthesis services for 3-(1-Oxo-2-phosphonoethyl)-2-piperidinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.