咪唑羟丙酮磷酸
TL;DR: 咪唑羟丙酮磷酸 (CAS 99979-59-6) is a chemical compound with molecular formula C6H9N2O5P and molecular weight 220.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
咪唑羟丙酮磷酸
[3-(1H-imidazol-5-yl)-2-oxopropyl] dihydrogen phosphate
Also Known As: Imidazole acetol phosphate, imidazole acetol-P, imidazole acetol-phosphate, Imidazole-acetol phosphate, 3-(imidazol-4-yl)-2-oxopropyl phosphate
| Molecular Formula | C6H9N2O5P |
|---|---|
| Molecular Weight | 220.02 g/mol |
| LogP | -2.0 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 220.0249 |
| Heavy Atoms | 14 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 99979-59-6 |
|---|---|
| SMILES | C1=C(NC=N1)CC(=O)COP(=O)(O)O |
| InChIKey | YCFFMSOLUMRAMD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
咪唑羟丙酮磷酸 (CAS 99979-59-6), with molecular formula C6H9N2O5P and molecular weight 220.02 g/mol. IUPAC: [3-(1H-imidazol-5-yl)-2-oxopropyl] dihydrogen phosphate.
Chemical Property Profile of 咪唑羟丙酮磷酸
Property Insights of 咪唑羟丙酮磷酸
The XLogP value of -2.0 indicates that 咪唑羟丙酮磷酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 咪唑羟丙酮磷酸. Following Lipinski's Rule of Five, 咪唑羟丙酮磷酸 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 咪唑羟丙酮磷酸?
The CAS number of 咪唑羟丙酮磷酸 is 99979-59-6.
What is the molecular formula of 咪唑羟丙酮磷酸?
The molecular formula of 咪唑羟丙酮磷酸 is C6H9N2O5P.
What is the molecular weight of 咪唑羟丙酮磷酸?
The molecular weight of 咪唑羟丙酮磷酸 is 220.02 g/mol.
Where can I buy 咪唑羟丙酮磷酸?
You can request a quote for 咪唑羟丙酮磷酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 咪唑羟丙酮磷酸?
Yes, KEHONG BIO provides custom synthesis services for 咪唑羟丙酮磷酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.