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Substance Name: Diethatyl-ethyl [ISO]
RN: 38727-55-8
UNII: U79T955O9J
InChIKey: WFKSADNZWSKCRZ-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Herbicide

Molecular Formula

  • C16-H22-Cl-N-O3

Molecular Weight

  • 311.807
 
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Names and Synonyms

Results Name

  • Diethatyl-ethyl [ISO]

Name of Substance

  • Diethatyl ethyl
  • Diethatyl-ethyl [ISO]

Synonyms

  • AC 22,234
  • Antor
  • BAY nnt 6867
  • Bay NTN 6867
  • BRN 2153901
  • Caswell No. 179D
  • Diethatyl ethyl
  • Diethatyl-ethyl
  • EINECS 254-105-3
  • EPA Pesticide Chemical Code 279500
  • H 22234
  • Hercules 22234
  • N-Chloroacetyl-N-(2,6-diethylphenyl)glycine ethyl ester
  • UNII-U79T955O9J

Systematic Names

  • Ethyl N-(chloroacetyl)-N-(2,6-diethylphenyl)glycinate
  • Glycine, N-(chloroacetyl)-N-(2,6-diethylphenyl)-, ethyl ester

Superlist Names

  • Antor
  • Diethatyl ethyl
  • N-Chloroacetyl-N-(2,6-diethylphenyl)glycine, ethyl ester

Registry Numbers

CAS Registry Number

  • 38727-55-8

FDA UNII

  • U79T955O9J

Other Registry Numbers

  • 51142-20-2
  • 52002-01-4
  • 62180-86-3

System Generated Number

  • 0038727558

Structure Descriptors

InChI

1S/C16H22ClNO3/c1-4-12-8-7-9-13(5-2)16(12)18(14(19)10-17)11-15(20)21-6-3/h7-9H,4-6,10-11H2,1-3H3

InChIKey

WFKSADNZWSKCRZ-UHFFFAOYSA-N

Smiles

c1(N(CC(OCC)=O)C(CCl)=O)c(cccc1CC)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
duck LD50 oral > 10gm/kg (10000mg/kg)   "Agrochemicals Handbook," with updates, Hartley, D., and H. Kidd, eds., Nottingham, Royal Soc of Chemistry, 1983-86Vol. A544, Pg. 1985,
mouse LD50 oral 1650mg/kg (1650mg/kg)   "Agrochemicals Handbook," with updates, Hartley, D., and H. Kidd, eds., Nottingham, Royal Soc of Chemistry, 1983-86Vol. A544, Pg. 1984,
quail LD50 oral > 10gm/kg (10000mg/kg)   "Agrochemicals Handbook," with updates, Hartley, D., and H. Kidd, eds., Nottingham, Royal Soc of Chemistry, 1983-86Vol. A544, Pg. 1985,
rabbit LD50 skin 4gm/kg (4000mg/kg)   Pesticide Manual. Vol. 9, Pg. 272, 1991.
rat LD50 oral 2300mg/kg (2300mg/kg)   Pesticide Manual. Vol. 9, Pg. 272, 1991.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 49-50 deg C   EXP
log P (octanol-water) 3.6 (none)   EXP
Water Solubility 105 mg/L 25 EXP
Vapor Pressure 1.62E-07 mm Hg 25 EST
Henry's Law Constant 6.03E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.37E-11 cm3/molecule-sec 25 EST

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