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Substance Name: Phosphonodithioic acid, ethyl-, O-isopropyl ester, S-ester with N-(mercaptomethyl)phthalimide
RN: 16537-51-2
InChIKey: XTPQVUHBEQVOSI-UHFFFAOYSA-N

Classification Codes

  • Acaricide
  • Agricultural Chemical
  • Insecticide

Molecular Formula

  • C14-H18-N-O3-P-S2

Molecular Weight

  • 343.406
 
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Names and Synonyms

Synonyms

  • AI3-27014
  • BRN 1486452
  • N 4539
  • N-(Mercaptomethyl)phthalimide-S-(O-isopropyl)-ethylphosphonodithioate
  • N-4543
  • O-Isopropyl-S-(phthalimidomethyl)-ethylphosphonodithioate
  • S-((1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl) O-(1-methylethyl) ethylphosphonodithioate
  • S-((N-Phthalimido)methyl) O-isopropoxy ethylphosphonodithioate

Systematic Names

  • Phosphonodithioic acid, ethyl-, O-isopropyl ester, S-ester with N-(mercaptomethyl)phthalimide
  • Phosphonodithioic acid, ethyl-, S-((1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl) O-(1-methylethyl) ester

Registry Numbers

CAS Registry Number

  • 16537-51-2

System Generated Number

  • 0016537512

Structure Descriptors

InChI

1S/C14H18NO3PS2/c1-4-19(20,18-10(2)3)21-9-15-13(16)11-7-5-6-8-12(11)14(15)17/h5-8,10H,4,9H2,1-3H3

InChIKey

XTPQVUHBEQVOSI-UHFFFAOYSA-N

Smiles

N1(C(c2ccccc2C1=O)=O)CS[P@@](=S)(OC(C)C)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 316mg/kg (316mg/kg)   Bulletin of the Entomological Society of America. Vol. 12, Pg. 161, 1966.
rabbit LD50 skin 121mg/kg (121mg/kg)   Bulletin of the Entomological Society of America. Vol. 12, Pg. 161, 1966.
rat LD50 oral 10mg/kg (10mg/kg)   Journal of Agricultural and Food Chemistry. Vol. 17, Pg. 863, 1969.