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Substance Name: Benzene, 1-ethoxy-2,4-dinitro-
RN: 610-54-8
InChIKey: YSOKMOXAGMIZFZ-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Experimental Pesticide
  • Mutation Data
  • Unspecified / Unclassified Pesticide

Molecular Formula

  • C8-H8-N2-O5

Molecular Weight

  • 212.16
 
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Names and Synonyms

Synonyms

  • 1-Ethoxy-2,4-dinitrobenzene
  • 2,4-Dinitrofenetol
  • 2,4-Dinitrofenetol [Czech]
  • 2,4-Dinitrophenetole
  • 2,4-Dinitrophenyl ethyl ether
  • 4-06-00-01373 (Beilstein Handbook Reference)
  • AI3-00707
  • BRN 1884582
  • EINECS 210-228-4
  • NSC 6227

Systematic Names

  • 2,4-Dinitrophenetole
  • Benzene, 1-ethoxy-2,4-dinitro-
  • Phenetole, 2,4-dinitro-

Registry Numbers

CAS Registry Number

  • 610-54-8

System Generated Number

  • 0000610548

Structure Descriptors

InChI

1S/C8H8N2O5/c1-2-15-8-4-3-6(9(11)12)5-7(8)10(13)14/h3-5H,2H2,1H3

InChIKey

YSOKMOXAGMIZFZ-UHFFFAOYSA-N

Smiles

c1(c(ccc(c1)[N+](=O)[O-])OCC)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo oral 250mg/kg (250mg/kg)   National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 16, 1953.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.200 (none)   EST
Water Solubility 204 mg/L 25 EST
Vapor Pressure 5.60E-05 mm Hg 25 EST
Henry's Law Constant 6.59E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.51E-12 cm3/molecule-sec 25 EST

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