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Your Location：Home>Product Center >> Pesticide API and intermediates >> Indoxacarb
  • Indoxacarb
Name:Indoxacarb
CAS No:144171-61-9
CAS No:173584-44-6

PRODUCT DESCRIPTION

【Name】
INDOXACARB
【CAS Registry number】

173584-44-6;

144171-61-9

【Synonyms】
Indoxacarb-Mp
Methyl 7-Chloro-2,5-Dihydro-2-[N-(Methoxycarbonyl)-4-(Trifluoromethoxy)Anilinocarbonyl]Indeno[1,2-E][1,3,4]Oxadiazine-4a(3h)Carboxylate
Indeno1,2-E1,3,4oxadiazine-4a(3h)-Carboxylic Acid, 7-Chloro-2,5-Dihydro-2-(Methoxycarbonyl)4-(Trifluoromethoxy)Phenylaminocarbonyl-, Methyl Ester, (4as)-
Indoxacarb (Bsi, Pa Iso, Ansi)
7-Chloro-2,5-Dihydro-2-(((Methoxycarbonyl)(4-(Trifluoromethoxy)Phenyl)Amino)Carbonyl)-Indeno[1,2-E][1,3,4]Oxadiazine-4a(3h)-Carboxylic Acid Methyl Ester
Indeno[1,2-E][1,3,4}Oxadiazine-4a(3h)Carboxylic
Indeno[1,2-E][1,3,4}Oxadiazine-4a(3h)Carboxylicacid,7-Chloro-2,5-Dihydro-2-[[(Methoxycarbonyl)[4-(T
Indeno[1,2-E][1,3,4}Oxadiazine-4a(3h)Carboxylicacid,7-Chloro-2,5-Dihydro-2-[[(Methoxycarbonyl)[4-(Trifluoro-Methoxy)Phenyl]Amin
Carprofen, Vetranal 
methyl (4aS)-7-chloro-2-{(methoxycarbonyl)[4-(trifluoromethoxy)phenyl]carbamoyl}-2,5-dihydroindeno[1,2-e][1,3,4]oxadiazine-4a(3H)-carboxylate
【Molecular Formula】
C22H17ClF3N3O7 (Products with the same molecular formula)
【Molecular Weight】
527.8345
【Inchi】
InChI=1/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
【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
【Isomers 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

Chemical and Physical Properties

【Density】
1.53g/cm3
【Melting Point】
88.1 deg C
【Boiling Point】
571.4°C at 760 mmHg
【Vapour】
4.59E-13mmHg at 25°C
【Refractive Index】
1.601
【Flash Point】
299.3°C
【Computed Properties】
Molecular Weight:527.83449 [g/mol]
Molecular Formula:C22H17ClF3N3O7
XLogP3-AA:4.8
H-Bond Donor:0
H-Bond Acceptor:11
Rotatable Bond Count:5
Exact Mass:527.070712
MonoIsotopic Mass:527.070712
Topological Polar Surface Area:107
Heavy Atom Count:36
Formal Charge:0
Complexity:912
Isotope Atom Count:0
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:6
Feature 3D Ring Count:4
Effective Rotor Count:9.8
Conformer Sampling RMSD:1
CID Conformer Count:48

Safety and Handling

【Formulations/Preparations】
Dispersible granule; suspension concentrate.
DPX-JW062 is a 1:1 mixture of the (active) (S)- and (inactive) (R)- isomers; DPX-MP062 is a 3:1 mixture of these isomers. The pure (S)- isomer is referred to as DPX-KN128, the (R)- isomer as DPX-KN127.
Trade names: Avaunt, Steward, Avatar, Rumo, Tornado
【Other Preventative Measures】
SRP: Local exhaust ventilation should be applied wherever there is an incidence of point source emissions or dispersion of regulated contaminants in the work area. Ventilation control of the contaminant as close to its point of generation is both the most economical and safest method to minimize personnel exposure to airborne contaminants.
SRP: Contaminated protective clothing should be segregated in such a manner so that there is no direct personal contact by personnel who handle, dispose, or clean the clothing. Quality assurance to ascertain the completeness of the cleaning procedures should be implemented before the decontaminated protective clothing is returned for reuse by the workers. Contaminated clothing should not be taken home at end of shift, but should remain at employee's place of work for cleaning.
The protective clothing should be kept in separate places where it cannot be contaminated with toxic chemicals. It should be forbidden to keep this clothing in living quarters. Protective clothing must be washed at least once a week and each time it is contaminated with pesticides. Before washing the clothing should be soaked for several hours in a calcium carbonate solution. /Pesticides/
Smoking, eating, and drinking before washing should be absolutely prohibited when any pesticide ... is being handled or used. /Pesticides/
【Octanol/Water Partition Coefficient】
log Kow = 4.65
【Disposal Methods】
SRP: The most favorable course of action is to use an alternative chemical product with less inherent propensity for occupational exposure or environmental contamination. Recycle any unused portion of the material for its approved use or return it to the manufacturer or supplier. Ultimate disposal of the chemical must consider: the material's impact on air quality; potential migration in soil or water; effects on animal, aquatic, and plant life; and conformance with environmental and public health regulations.

Use and Manufacturing

【Use and Manufacturing】
Methods of Manufacturing

Preparation: G.D. Annis et al, WO 92 11249 (1992 to DuPont); eidem, US 5462938 (1995)

Environmental Fate and Exposure Potential

【Environmental Fate/Exposure Summary】
TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 8,100(SRC), determined from a log Kow of 4.65(2) and a regression-derived equation(3), indicates that indoxacarb is expected to be immobile in soil(SRC). Volatilization of indoxacarb from moist soil surfaces is not expected to be an important fate process(SRC) given an estimated Henry's Law constant of 6.6X10-10 atm-cu m/mole(SRC), derived from its vapor pressure, 1.9X10-10 mm Hg(2), and water solubility, 0.20 mg/L(2). Indoxacarb is not expected to volatilize from dry soil surfaces(SRC) based upon its vapor pressure(2). Biodegradation data were not available(SRC, 2005).
AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 8,100(SRC), determined from a log Kow of 4.65(2) and a regression-derived equation(3), indicates that indoxacarb is expected to adsorb to suspended solids and sediment(SRC). Volatilization from water surfaces is not expected(3) based upon an estimated Henry's Law constant of 6.6X10-10 atm-cu m/mole(SRC), derived from its vapor pressure, 1.9X10-10 mm Hg(2), and water solubility, 0.20 mg/L(2). According to a classification scheme(4), an estimated BCF of 2,000(SRC), from an estimated log Kow(2) and a regression-derived equation(5), suggests the potential for bioconcentration in aquatic organisms is very high(SRC). Aqueous hydrolysis half-lives measured for indoxacarb were greater than 30 days at pH 5, 38 days at pH 7, and 1 day at pH 9(2). Biodegradation data were not available(SRC, 2005).
ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), indoxacarb, which has a vapor pressure of 1.9X10-10 mm Hg at 25 deg C(2), is expected to exist solely in the particulate phase in the ambient atmosphere. Particulate-phase indoxacarb may be removed from the air by wet and dry deposition(SRC).

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