Indoxacarb
TL;DR: Indoxacarb (CAS 173584-44-6) is a chemical compound with molecular formula C22H17ClF3N3O7 and molecular weight 527.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (4aS)-7-chloro-2-[methoxycarbonyl-[4-(trifluoromethoxy)phenyl]carbamoyl]-3,5-dihydroindeno[1,2-e][1,3,4]oxadiazine-4a-carboxylate
Also Known As: Indoxacarb, Steward, Insecticide, Provaunt, Advion
| Molecular Formula | C22H17ClF3N3O7 |
|---|---|
| Molecular Weight | 527.07 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 527.07074 |
| Heavy Atoms | 36 |
| Complexity | 912.0 |
| Melting Point | 88.1 °C |
| Density | 1.44 g/cu cm at 20 °C |
| Solubility | Solubility in n-octanol 14.5 g/L, methanol 103 g/L, acetonitrile 139 g/L, acetone >250 g/kg (all at 25 °C) |
| Vapor Pressure | 1.9X10-10 mm Hg at 25 °C |
Chemical Identifiers
| CAS Number | 173584-44-6 |
|---|---|
| SMILES | COC(=O)[C@]12CC3=C(C1=NN(CO2)C(=O)N(C4=CC=C(C=C4)OC(F)(F)F)C(=O)OC)C=CC(=C3)Cl |
| InChIKey | VBCVPMMZEGZULK-NRFANRHFSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Indoxacarb (CAS 173584-44-6), with molecular formula C22H17ClF3N3O7 and molecular weight 527.07 g/mol. IUPAC: methyl (4aS)-7-chloro-2-[methoxycarbonyl-[4-(trifluoromethoxy)phenyl]carbamoyl]-3,5-dihydroindeno[1,2-e][1,3,4]oxadiazine-4a-carboxylate.
Chemical Property Profile of Indoxacarb
Property Insights of Indoxacarb
The XLogP value of 4.8 indicates that Indoxacarb is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Indoxacarb. Following Lipinski's Rule of Five, Indoxacarb has 0 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Indoxacarb?
The CAS number of Indoxacarb is 173584-44-6.
What is the molecular formula of Indoxacarb?
The molecular formula of Indoxacarb is C22H17ClF3N3O7.
What is the molecular weight of Indoxacarb?
The molecular weight of Indoxacarb is 527.07 g/mol.
Where can I buy Indoxacarb?
You can request a quote for Indoxacarb directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indoxacarb?
Yes, KEHONG BIO provides custom synthesis services for Indoxacarb and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.