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Substance Name: Nitrofluorfen [ANSI]
RN: 42874-01-1
UNII: Y97DI21M86
InChIKey: ZGGSVBWJVIXBHV-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Herbicide
  • Out-Dated Pesticide

Molecular Formula

  • C13-H7-Cl-F3-N-O3

Molecular Weight

  • 317.649
 
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Names and Synonyms

Results Name

  • Nitrofluorfen [ANSI]

Name of Substance

  • 2-Chloro-4-trifluoromethylphenyl 4-nitrophenyl ether

Synonyms

  • 2-Chloro-1-(4-nitrophenoxy)-4-trifluoromethylbenzene
  • Benzene, 2-chloro-1-(4-nitrophenoxy)-4-(trifluoromethyl)- (9CI)
  • BRN 2061985
  • Nitrofluorfen
  • Nitrofluorfen [ANSI]
  • Nitrofluorfene
  • Nitrofluorofen
  • RH-2512
  • UNII-Y97DI21M86

Systematic Names

  • Benzene, 2-chloro-1-(4-nitrophenoxy)-4-(trifluoromethyl)-
  • Ether, 2-chloro-alpha,alpha,alpha-trifluoro-p-tolyl p-nitrophenyl

Registry Numbers

CAS Registry Number

  • 42874-01-1

FDA UNII

  • Y97DI21M86

System Generated Number

  • 0042874011

Structure Descriptors

InChI

1S/C13H7ClF3NO3/c14-11-7-8(13(15,16)17)1-6-12(11)21-10-4-2-9(3-5-10)18(19)20/h1-7H

InChIKey

ZGGSVBWJVIXBHV-UHFFFAOYSA-N

Smiles

c1(Oc2ccc([N+](=O)[O-])cc2)c(cc(C(F)(F)F)cc1)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 oral > 5gm/kg (5000mg/kg)   Journal of Agricultural and Food Chemistry. Vol. 23, Pg. 592, 1975.
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Journal of Agricultural and Food Chemistry. Vol. 23, Pg. 592, 1975.
rat LD50 oral 1gm/kg (1000mg/kg)   "Agricultural Chemicals," Thomson, W.T., 4 vols., Fresno, CA, Thomson Publications, 1976/77 revisionVol. 2, Pg. 200, 1977.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 68 deg C   EXP
log P (octanol-water) 4.54 (none)   EXP
Water Solubility 0.523 mg/L 25 EST
Vapor Pressure 6.92E-06 mm Hg 25 EST
Henry's Law Constant 2.99E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.85E-13 cm3/molecule-sec 25 EST

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