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Substance Name: Dicapthon oxon
RN: 17650-76-9
InChIKey: BLVSIGRJPXXNPD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H9-Cl-N-O6-P

Molecular Weight

  • 281.587
 
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Names and Synonyms

Results Name

  • Dicapthon oxon

Synonyms

  • BAY 62944
  • BRN 4501136
  • Dicapthon oxygen analogue
  • Dicapthon-oxon
  • Dicapthoxon
  • Dimethyl 2-chloro-4-nitrophenyl phosphate

Systematic Name

  • Phosphoric acid, dimethyl 2-chloro-4-nitrophenyl ester

Registry Numbers

CAS Registry Number

  • 17650-76-9

System Generated Number

  • 0017650769

Structure Descriptors

InChI

1S/C8H9ClNO6P/c1-14-17(13,15-2)16-8-4-3-6(10(11)12)5-7(8)9/h3-5H,1-2H3

InChIKey

BLVSIGRJPXXNPD-UHFFFAOYSA-N

Smiles

O=P(OC)(OC)Oc1c(Cl)cc([N+](=O)[O-])cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 99mg/kg (99mg/kg)   Pesticide Biochemistry and Physiology. Vol. 3, Pg. 149, 1973.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.83 (none)   EXP
Water Solubility 175 mg/L 25 EST
Vapor Pressure 1.04E-05 mm Hg 25 EST
Henry's Law Constant 2.69E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.71E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.