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Substance Name: Quinoline, 6-methyl-4-nitro-, 1-oxide
RN: 715-48-0
InChIKey: VJJJEAZZHWTTED-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C10-H8-N2-O3

Molecular Weight

  • 204.184
 
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Names and Synonyms

Synonyms

  • 4-20-00-03495 (Beilstein Handbook Reference)
  • 6-Methyl-4-nitroquinoline 1-oxide
  • BRN 0187028
  • CCRIS 1147

Systematic Names

  • 6-Methyl-4-nitroquinoline 1-oxide
  • Quinoline, 6-methyl-4-nitro-, 1-oxide

Registry Numbers

CAS Registry Number

  • 715-48-0

System Generated Number

  • 0000715480

Structure Descriptors

InChI

1S/C10H8N2O3/c1-7-2-3-9-8(6-7)10(12(14)15)4-5-11(9)13/h2-6H,1H3

InChIKey

VJJJEAZZHWTTED-UHFFFAOYSA-N

Smiles

c1c(C)cc2c([N+]([O-])=O)ccn(=O)c2c1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo intraperitoneal 60mg/kg (60mg/kg)   Biochemical Pharmacology. Vol. 13, Pg. 285, 1964.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.43 (none)   EXP
Water Solubility 1040 mg/L 25 EST
Vapor Pressure 1.06E-06 mm Hg 25 EST
Henry's Law Constant 3.00E-14 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.83E-12 cm3/molecule-sec 25 EST

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