Dicapthon oxon
TL;DR: Dicapthon oxon (CAS 17650-76-9) is a chemical compound with molecular formula C8H9ClNO6P and molecular weight 280.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-4-nitrophenyl) dimethyl phosphate
Also Known As: Dicapthoxon, Dicapthon oxon, Dicapthon-oxon, Dicapthon oxygen analogue, (2-chloro-4-nitrophenyl) dimethyl phosphate
| Molecular Formula | C8H9ClNO6P |
|---|---|
| Molecular Weight | 280.99 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 90.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.9856 |
| Heavy Atoms | 17 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 17650-76-9 |
|---|---|
| SMILES | COP(=O)(OC)OC1=C(C=C(C=C1)[N+](=O)[O-])Cl |
| InChIKey | BLVSIGRJPXXNPD-UHFFFAOYSA-N |
Product Overview
Dicapthon oxon (CAS 17650-76-9), with molecular formula C8H9ClNO6P and molecular weight 280.99 g/mol. IUPAC: (2-chloro-4-nitrophenyl) dimethyl phosphate.
Chemical Property Profile of Dicapthon oxon
Property Insights of Dicapthon oxon
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dicapthon oxon. The TPSA of 90.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Dicapthon oxon. Following Lipinski's Rule of Five, Dicapthon oxon has 0 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 Dicapthon oxon?
The CAS number of Dicapthon oxon is 17650-76-9.
What is the molecular formula of Dicapthon oxon?
The molecular formula of Dicapthon oxon is C8H9ClNO6P.
What is the molecular weight of Dicapthon oxon?
The molecular weight of Dicapthon oxon is 280.99 g/mol.
Where can I buy Dicapthon oxon?
You can request a quote for Dicapthon oxon directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dicapthon oxon?
Yes, KEHONG BIO provides custom synthesis services for Dicapthon oxon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.