Isoxapyrifop
TL;DR: Isoxapyrifop (CAS 87757-18-4) is a chemical compound with molecular formula C17H16Cl2N2O4 and molecular weight 382.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenoxy]-1-(1,2-oxazolidin-2-yl)propan-1-one
Also Known As: Isoxapyrifop, Isoxapyrifop [ISO], ISOXAPYRIFOP, (RS)-, ISOXAPYRIFOP, (+-)-, ISOXAPYRIFOP, (+/-)-
| Molecular Formula | C17H16Cl2N2O4 |
|---|---|
| Molecular Weight | 382.05 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.0487 |
| Heavy Atoms | 25 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 87757-18-4 |
|---|---|
| SMILES | CC(C(=O)N1CCCO1)OC2=CC=C(C=C2)OC3=C(C=C(C=N3)Cl)Cl |
| InChIKey | ANFHKXSOSRDDRQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isoxapyrifop (CAS 87757-18-4), with molecular formula C17H16Cl2N2O4 and molecular weight 382.05 g/mol. IUPAC: 2-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenoxy]-1-(1,2-oxazolidin-2-yl)propan-1-one.
Chemical Property Profile of Isoxapyrifop
Property Insights of Isoxapyrifop
The XLogP value of 4.0 indicates that Isoxapyrifop is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Isoxapyrifop. Following Lipinski's Rule of Five, Isoxapyrifop has 0 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 Isoxapyrifop?
The CAS number of Isoxapyrifop is 87757-18-4.
What is the molecular formula of Isoxapyrifop?
The molecular formula of Isoxapyrifop is C17H16Cl2N2O4.
What is the molecular weight of Isoxapyrifop?
The molecular weight of Isoxapyrifop is 382.05 g/mol.
Where can I buy Isoxapyrifop?
You can request a quote for Isoxapyrifop directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoxapyrifop?
Yes, KEHONG BIO provides custom synthesis services for Isoxapyrifop and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.