3,4,5-三羟基-2-戊酮-5-磷酸
TL;DR: 3,4,5-三羟基-2-戊酮-5-磷酸 (CAS 190079-18-6) is a chemical compound with molecular formula C5H11O7P and molecular weight 214.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-三羟基-2-戊酮-5-磷酸
(2,3-dihydroxy-4-oxopentyl) dihydrogen phosphate
Also Known As: DOXP, 1-deoxy-D-xylulose 5-phosphate, 3,4,5-Trihydroxy-2-pentanone 5-phosphate, (2,3-dihydroxy-4-oxopentyl) dihydrogen phosphate, [(2,3-dihydroxy-4-oxopentyl)oxy]phosphonic acid
| Molecular Formula | C5H11O7P |
|---|---|
| Molecular Weight | 214.02 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 214.02425 |
| Heavy Atoms | 13 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 190079-18-6 |
|---|---|
| SMILES | CC(=O)C(C(COP(=O)(O)O)O)O |
| InChIKey | AJPADPZSRRUGHI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4,5-三羟基-2-戊酮-5-磷酸 (CAS 190079-18-6), with molecular formula C5H11O7P and molecular weight 214.02 g/mol. IUPAC: (2,3-dihydroxy-4-oxopentyl) dihydrogen phosphate.
Chemical Property Profile of 3,4,5-三羟基-2-戊酮-5-磷酸
Property Insights of 3,4,5-三羟基-2-戊酮-5-磷酸
The XLogP value of -3.1 indicates that 3,4,5-三羟基-2-戊酮-5-磷酸 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 3,4,5-三羟基-2-戊酮-5-磷酸. Following Lipinski's Rule of Five, 3,4,5-三羟基-2-戊酮-5-磷酸 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
Frequently Asked Questions
What is the CAS number of 3,4,5-三羟基-2-戊酮-5-磷酸?
The CAS number of 3,4,5-三羟基-2-戊酮-5-磷酸 is 190079-18-6.
What is the molecular formula of 3,4,5-三羟基-2-戊酮-5-磷酸?
The molecular formula of 3,4,5-三羟基-2-戊酮-5-磷酸 is C5H11O7P.
What is the molecular weight of 3,4,5-三羟基-2-戊酮-5-磷酸?
The molecular weight of 3,4,5-三羟基-2-戊酮-5-磷酸 is 214.02 g/mol.
Where can I buy 3,4,5-三羟基-2-戊酮-5-磷酸?
You can request a quote for 3,4,5-三羟基-2-戊酮-5-磷酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5-三羟基-2-戊酮-5-磷酸?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5-三羟基-2-戊酮-5-磷酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.