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Substance Name: Phosphonic acid, ethyl-, butyl p-nitrophenyl ester
RN: 71002-67-0
InChIKey: IDBGACONKGMGDO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H18-N-O5-P

Molecular Weight

  • 287.2502
 
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Names and Synonyms

Synonyms

  • 4-06-00-01320 (Beilstein Handbook Reference)
  • BRN 3410124
  • Butyl p-nitrophenyl ester of ethylphosphonic acid
  • Ethylphosphonic acid butyl p-nitrophenyl ester

Systematic Name

  • Phosphonic acid, ethyl-, butyl p-nitrophenyl ester

Registry Numbers

CAS Registry Number

  • 71002-67-0

System Generated Number

  • 0071002670

Structure Descriptors

InChI

1S/C12H18NO5P/c1-3-5-10-17-19(16,4-2)18-12-8-6-11(7-9-12)13(14)15/h6-9H,3-5,10H2,1-2H3

InChIKey

IDBGACONKGMGDO-UHFFFAOYSA-N

Smiles

CCCCOP(=O)(CC)Oc1ccc(cc1)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 1300ug/kg (1.3mg/kg)   Russian Pharmacology and Toxicology Vol. 42, Pg. 106, 1979.
mouse LD50 subcutaneous 1500ug/kg (1.5mg/kg)   Russian Pharmacology and Toxicology Vol. 42, Pg. 106, 1979.
rat LD50 intravenous 1300ug/kg (1.3mg/kg) LUNGS, THORAX, OR RESPIRATION: BRONCHIOLAR CONSTRICTION

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES
Farmakologiya i Toksikologiya Vol. 42, Pg. 299, 1979.
rat LD50 subcutaneous 1500ug/kg (1.5mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

LUNGS, THORAX, OR RESPIRATION: BRONCHIOLAR CONSTRICTION
Farmakologiya i Toksikologiya Vol. 42, Pg. 299, 1979.