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Substance Name: 2,6-Dinitrophenol
RN: 573-56-8
UNII: F4QM4I92KC
InChIKey: JCRIDWXIBSEOEG-UHFFFAOYSA-N

Molecular Formula

  • C6-H4-N2-O5

Molecular Weight

  • 184.107
 

Classification Codes

Classification Code

  • Drug / Therapeutic Agent

Superlist Classification Code

  • Reportable Quantity (RQ) = 10 lb
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Names and Synonyms

Name of Substance

  • 2,6-Dinitrophenol

Synonyms

  • 2,6-Dinitrofenol
  • 2,6-Dinitrofenol [Czech]
  • 2,6-Dinitrophenol
  • 2,6-DNP
  • 4-06-00-01383 (Beilstein Handbook Reference)
  • beta-Dinitrophenol
  • BRN 1913410
  • CCRIS 3104
  • EINECS 209-357-9
  • HSDB 6306
  • NSC 6215
  • o-Dinitrophenol
  • Phenol, 2,6-dinitro-
  • Phenol, beta-dinitro-
  • UNII-F4QM4I92KC

Systematic Names

  • 2,6-Dinitrophenol
  • Phenol, 2,6-dinitro-

Superlist Names

  • 2,6-Dinitrophenol
  • Phenol, 2,6-dinitro-

Registry Numbers

CAS Registry Number

  • 573-56-8

FDA UNII

  • F4QM4I92KC

System Generated Number

  • 0000573568

Structure Descriptors

InChI

1S/C6H4N2O5/c9-6-4(7(10)11)2-1-3-5(6)8(12)13/h1-3,9H

InChIKey

JCRIDWXIBSEOEG-UHFFFAOYSA-N

Smiles

c1(c(c([N+](=O)[O-])ccc1)O)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LDLo intraperitoneal 50mg/kg (50mg/kg)   Journal of Pharmacy and Pharmacology. Vol. 11, Pg. 462, 1959.
mouse LD50 intraperitoneal 45mg/kg (45mg/kg)   Journal of Pharmacy and Pharmacology. Vol. 11, Pg. 462, 1959.
pigeon LDLo intramuscular 40mg/kg (40mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 49, Pg. 187, 1933.
rat LD50 intraperitoneal 38mg/kg (38mg/kg)   Journal of Pharmacy and Pharmacology. Vol. 11, Pg. 462, 1959.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 63.5 deg C   EXP
pKa Dissociation Constant 3.965 (none) 25 EXP
log P (octanol-water) 1.37 (none)   EXP
Water Solubility 5190 mg/L 50 EXP
Vapor Pressure 1.20E-05 mm Hg 25 EST
Henry's Law Constant 2.76E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.61E-13 cm3/molecule-sec 25 EST

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