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Substance Name: Quinoline, 4,8-dinitro-, 1-oxide
RN: 14753-19-6
InChIKey: VTEYIVXQGGFQFY-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C9-H5-N3-O5

Molecular Weight

  • 235.154
 
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Names and Synonyms

Synonyms

  • 4,8-Dinitroquinoline N-oxide
  • 4-20-00-03408 (Beilstein Handbook Reference)
  • BRN 0255358

Systematic Name

  • Quinoline, 4,8-dinitro-, 1-oxide

Registry Numbers

CAS Registry Number

  • 14753-19-6

System Generated Number

  • 0014753196

Structure Descriptors

InChI

1S/C9H5N3O5/c13-10-5-4-7(11(14)15)6-2-1-3-8(9(6)10)12(16)17/h1-5H

InChIKey

VTEYIVXQGGFQFY-UHFFFAOYSA-N

Smiles

c1ccc2c([N+]([O-])=O)cc[n+]([O-])c2c1[N+]([O-])=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.76 (none)   EXP
Water Solubility 1800 mg/L 25 EST
Vapor Pressure 4.65E-08 mm Hg 25 EST
Henry's Law Constant 1.07E-16 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.57E-13 cm3/molecule-sec 25 EST

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