Indoxacarb

Indoxacarb

Category:

CAS:

Description:
an oxadiazine pesticide developed by DuPont that acts against lepidopteran larvae.

CID 107720
Deprecated CAS 174060-41-4
Synonyms Methyl 7-chloro-2,5-dihydro-2-[[(methoxycarbonyl)[4-(trifluoromethoxy)phenyl]amino]carbonyl]indeno[1,2-e][1,3,4]oxadiazine-4a(3H)-carboxylate
IUPAC Name methyl (4aS)-7-chloro-2-[methoxycarbonyl-[4-(trifluoromethoxy)phenyl]carbamoyl]-3,5-dihydroindeno[1,2-e][1,3,4]oxadiazine-4a-carboxylate
Molecular Weight 527.84
Molecular Formula C22H17ClF3N3O7
Canonical SMILES COC(=O)C12CC3=C(C1=NN(CO2)C(=O)N(C4=CC=C(C=C4)OC(F)(F)F)C(=O)OC)C=CC(=C3)Cl
InChI InChI=1S/C22H17ClF3N3O7/c1-33-18(30)21-10-12-9-13(23)3-8-16(12)17(21)27-28(11-35-21)19(31)29(20(32)34-2)14-4-6-15(7-5-14)36-22(24,25)26/h3-9H,10-11H2,1-2H3/t21-/m0/s1
InChIKey VBCVPMMZEGZULK-NRFANRHFSA-N
Isomeric 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
EC Number 605-683-4
UNII 52H0D26MWR

Producut details

Formulation 150k/LSC, 30%WDG
Grade 90%TC 95%TC 70%TK
Toxicity Neurotoxin-Other CNS neurotoxin
Hemolytic anemia-Decreased hemoglobin or number of red blood cells.
Skin Sensitizer-An agent that can induce an allergic reaction in the skin.
Appearance solid
Compatibility Compatible with most insecticides and fungicides.
Melting Point 88.1 °C
Water In water, 0.20 mg/L at 20 °C
Shelf Life Limited shelf life, expiry date on the label

Chemical and Physical Properties

Purity > 95%
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)
Complexity 912
Exact Mass 527.0707121
Heavy Atom Count 36
Hydrogen Bond Acceptor Count 11
Hydrogen Bond Donor Count 0
Monoisotopic Mass 527.0707121
Rotatable Bond Count 5
Topological Polar Surface Area 107
XLogP3 4.8

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