2-羟基-3-氧代丁基磷酸酯
TL;DR: 2-羟基-3-氧代丁基磷酸酯 (CAS 114155-98-5) is a chemical compound with molecular formula C4H9O6P and molecular weight 184.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-羟基-3-氧代丁基磷酸酯
(2-hydroxy-3-oxobutyl) dihydrogen phosphate
Also Known As: 2-hydroxy-3-oxobutyl phosphate, NCIOpen2_001760, (2-hydroxy-3-oxobutyl) dihydrogen phosphate, 3,4-Dihydroxy-2-butanone 4-phosphate, 1-deoxy-L-glycero-tetrulose 4-phosphate
| Molecular Formula | C4H9O6P |
|---|---|
| Molecular Weight | 184.01 g/mol |
| LogP | -2.5 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 184.01367 |
| Heavy Atoms | 11 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 114155-98-5 |
|---|---|
| SMILES | CC(=O)C(COP(=O)(O)O)O |
| InChIKey | OKYHYXLCTGGOLM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-羟基-3-氧代丁基磷酸酯 (CAS 114155-98-5), with molecular formula C4H9O6P and molecular weight 184.01 g/mol. IUPAC: (2-hydroxy-3-oxobutyl) dihydrogen phosphate.
Chemical Property Profile of 2-羟基-3-氧代丁基磷酸酯
Property Insights of 2-羟基-3-氧代丁基磷酸酯
The XLogP value of -2.5 indicates that 2-羟基-3-氧代丁基磷酸酯 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-羟基-3-氧代丁基磷酸酯. Following Lipinski's Rule of Five, 2-羟基-3-氧代丁基磷酸酯 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 2-羟基-3-氧代丁基磷酸酯?
The CAS number of 2-羟基-3-氧代丁基磷酸酯 is 114155-98-5.
What is the molecular formula of 2-羟基-3-氧代丁基磷酸酯?
The molecular formula of 2-羟基-3-氧代丁基磷酸酯 is C4H9O6P.
What is the molecular weight of 2-羟基-3-氧代丁基磷酸酯?
The molecular weight of 2-羟基-3-氧代丁基磷酸酯 is 184.01 g/mol.
Where can I buy 2-羟基-3-氧代丁基磷酸酯?
You can request a quote for 2-羟基-3-氧代丁基磷酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-羟基-3-氧代丁基磷酸酯?
Yes, KEHONG BIO provides custom synthesis services for 2-羟基-3-氧代丁基磷酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.