Chloroacetol phosphate
TL;DR: Chloroacetol phosphate (CAS 27210-18-0) is a chemical compound with molecular formula C3H6ClO5P and molecular weight 187.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chloro-2-oxopropyl) dihydrogen phosphate
Also Known As: Chloroacetol phosphate, Chloroacetal phosphate, 3-Chloroacetal phosphate, Chlorohydroxyacetone phosphate, 3-Chloro-1-hydroxypropan-2-one phosphate
| Molecular Formula | C3H6ClO5P |
|---|---|
| Molecular Weight | 187.96 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 187.96414 |
| Heavy Atoms | 10 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 27210-18-0 |
|---|---|
| SMILES | C(C(=O)CCl)OP(=O)(O)O |
| InChIKey | OAZBZQJUELMYST-UHFFFAOYSA-N |
Product Overview
Chloroacetol phosphate (CAS 27210-18-0), with molecular formula C3H6ClO5P and molecular weight 187.96 g/mol. IUPAC: (3-chloro-2-oxopropyl) dihydrogen phosphate.
Chemical Property Profile of Chloroacetol phosphate
Property Insights of Chloroacetol phosphate
The XLogP value of -1.2 indicates that Chloroacetol phosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Chloroacetol phosphate. Following Lipinski's Rule of Five, Chloroacetol phosphate has 2 hydrogen bond donor(s) and 5 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 Chloroacetol phosphate?
The CAS number of Chloroacetol phosphate is 27210-18-0.
What is the molecular formula of Chloroacetol phosphate?
The molecular formula of Chloroacetol phosphate is C3H6ClO5P.
What is the molecular weight of Chloroacetol phosphate?
The molecular weight of Chloroacetol phosphate is 187.96 g/mol.
Where can I buy Chloroacetol phosphate?
You can request a quote for Chloroacetol phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chloroacetol phosphate?
Yes, KEHONG BIO provides custom synthesis services for Chloroacetol phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.