ChemSpider 2D Image | clethodim | C17H26ClNO3S

clethodim

  • Molecular FormulaC17H26ClNO3S
  • Average mass359.911 Da
  • Monoisotopic mass359.132202 Da
  • ChemSpider ID28295602

  • Double-bond stereo - Double-bond stereo

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-[(1E)-N-{[(2E)-3-Chlor-2-propen-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxy-2-cyclohexen-1-on [German] [ACD/IUPAC Name]
2-[(1E)-N-{[(2E)-3-Chloro-2-propen-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxy-2-cyclohexen-1-one [ACD/IUPAC Name]
2-[(1E)-N-{[(2E)-3-Chloro-2-propén-1-yl]oxy}propanimidoyl]-5-[2-(éthylsulfanyl)propyl]-3-hydroxy-2-cyclohexén-1-one [French] [ACD/IUPAC Name]
2-[1-[[[(2E)-3-Chloro-2-propen-1-yl]oxy]imino]propyl]-5-[2-(ethylthio)propyl]-3-hydroxy-2-cyclohexen-1-one
2-Cyclohexen-1-one, 2-[(1E)-1-[[[(2E)-3-chloro-2-propen-1-yl]oxy]imino]propyl]-5-[2-(ethylthio)propyl]-3-hydroxy- [ACD/Index Name]
99129-21-2 [RN]
clethodim [BSI] [ISO]
cléthodime [French]
клетодим [Russian]
烯草酮 [Chinese]
More...
  • Miscellaneous

    • Chemical Class:

      An oxime O-ether resulting from the formal conversion ot the acyclic keto group of 5-[2-(ethylsulfanyl)propyl]-3-hydroxy-2-propionylcyclohex-2-en-1-one to the corresponding oxime wi; th subsequent O-a lkylation of the oxime by an (E)-3-chloroallyl group. It is used as a selective postemergence herbicide for the control of annual and perennial gra; sses in numerous crops, including alfalfa, celery, clover, conifers, cotton, cranberries, garlic, onions, ornamentals, peanuts, soybeans, strawberries, sugarbeet, sunflowers, and vegetables; the (<minus/>)-enantiomer has been reported to be more activ e than the (+)-enantiomer. ChEBI CHEBI:70721
      An oxime O-ether resulting from the formal conversion ot the acyclic keto group of 5-[2-(ethylsulfanyl)propyl]-3-hydroxy-2-propionylcyclohex-2-en-1-one to the corresponding oxime with subsequent O-alk ylation of the oxime by an (E)-3-chloroallyl group. It is used as a selective postemergence herbicide for the control of annual and perennial grasses in numerous crops, including alfalfa, celery, clov er, conifers, cotton, cranberries, garlic, onions, ornamentals, peanuts, soybeans, strawberries, sugarbeet, sunflowers, and vegetables; the (-)-enantiomer has been reported to be more active than the (+)-enantiomer. ChEBI CHEBI:70721

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 472.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 84.8±6.0 kJ/mol
Flash Point: 239.6±31.5 °C
Index of Refraction: 1.545
Molar Refractivity: 96.3±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.50
ACD/LogD (pH 5.5): 2.59
ACD/BCF (pH 5.5): 19.71
ACD/KOC (pH 5.5): 88.36
ACD/LogD (pH 7.4): 1.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.02
Polar Surface Area: 84 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 39.1±7.0 dyne/cm
Molar Volume: 304.7±7.0 cm3

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