4-NITROQUINOLINE N-OXIDE

4-NITROQUINOLINE N-OXIDE Basic information
Product Name:4-NITROQUINOLINE N-OXIDE
Synonyms:TIMTEC-BB SBB006266;4-nitrochinolinn-oxid;4-nitrochinolinn-oxid(swedish);4-nitro-quinolin1-oxide;4-nitroquinolineoxide;4-nqo;nitrochin;Quinoline, 4-nitro-, 1-oxide
CAS:56-57-5
MF:C9H6N2O3
MW:190.16
EINECS:200-281-1
Product Categories:pharmacetical;Nitroquinolines;Quinolines
Mol File:56-57-5.mol
4-NITROQUINOLINE N-OXIDE Structure
4-NITROQUINOLINE N-OXIDE Chemical Properties
Melting point 154-156 °C(lit.)
Boiling point 325.64°C (rough estimate)
density 1.42
refractive index 1.5570 (estimate)
storage temp. -20°C
solubility acetone: clear to hazy
pka-1.83±0.10(Predicted)
form Crystalline Solid
color yellow to brown
BRN 165756
Stability:Stable. Hygroscopic, light-sensitive. Incompatible with strong oxidizing agents.
InChIKeyYHQDZJICGQWFHK-UHFFFAOYSA-N
CAS DataBase Reference56-57-5(CAS DataBase Reference)
EPA Substance Registry System4-Nitroquinoline 1-oxide (56-57-5)
Safety Information
Hazard Codes T
Risk Statements 45-68-40-20/21/22
Safety Statements 53-45-36/37-22
RIDADR 2811
WGK Germany 3
RTECS VC2100000
HazardClass 6.1
PackingGroup II
HS Code 29339900
Hazardous Substances Data56-57-5(Hazardous Substances Data)
ToxicityLD50 intraperitoneal in mouse: 190mg/kg
MSDS Information
ProviderLanguage
SigmaAldrich English
ACROS English
ALFA English
4-NITROQUINOLINE N-OXIDE Usage And Synthesis
Chemical Propertiesyellow-brown crystals or powder
Uses4-Nitroquinoline N-Oxide is used in method for constructing animal model of oral mucosal malignancy related to Kras mutation.
Uses4-Nitroquinoline N-oxide has been used as a model compound to study its carcinogenic effects.
DefinitionChEBI: A quinoline N-oxide carrying a nitro substituent at position 4.
General DescriptionYellowish-brown plates or needles or yellow solid.
Air & Water Reactions4-NITROQUINOLINE N-OXIDE is hygroscopic and light sensitive. Insoluble in water.
Reactivity Profile4-NITROQUINOLINE N-OXIDE reacts with strong oxidizing agents.
Health HazardACUTE/CHRONIC HAZARDS: 4-NITROQUINOLINE N-OXIDE may cause irritation. When heated to decomposition it may emit toxic fumes of carbon monoxide, carbon dioxide and nitrogen oxides.
Fire HazardFlash point data for 4-NITROQUINOLINE N-OXIDE are not available; however, 4-NITROQUINOLINE N-OXIDE is probably combustible.
Biochem/physiol ActionsSkin and lung tumor initiator under experimental conditions.
Safety ProfileSuspected carcinogen with experimental carcinogenic, neoplas tigenic, and tumorigenic data. Poison by intraperitoneal and subcutaneous routes. An experimental teratogen. Other experimental reproductive effects. Human mutation data reported. When heated to decomposition it emits toxic fumes of NOx.
Purification MethodsThe N-oxide recrystallises from aqueous acetone as yellow needles or platelets. [Ochiai J Org Chem 18 534 1953, Seki et al. J Phys Chem 91 126 1987, Beilstein 20 III/IV 3396.]
5-METHYL-4-NITROQUINOLINE-1-OXIDE 6-CHLORO-4-NITROQUINOLINE-1-OXIDE 7-Methyl-4-nitroquinoline 1-oxide 6,7-DICHLORO-4-NITROQUINOLINE-1-OXIDE 3-CHLORO-4-NITROQUINOLINE-1-OXIDE 4-NITROQUINOLINE N-OXIDE 2-methyl-4-nitroquinoline 1-oxide 4-(Hydroxyamino)-6-nitroquinoline 1-oxide 6-Butyl-4-nitroquinoline 1-oxide 5-CHLORO-4-NITROQUINOLINE-1-OXIDE Quinoline, 4,8-dinitro-, 1-oxide 6-METHYL-4-NITROQUINOLINE-1-OXIDE 8-METHYL-4-NITROQUINOLINE-1-OXIDE 3-BROMO-4-NITROQUINOLINE-1-OXIDE 6-CARBOXY-4-NITROQUINOLINE1-OXIDE 4-NITROQUINOLINE-N-OXIDE, [3-3H] PYRIDINES MIXTURE 3-methyl-4-nitroquinoline 1-oxide,3-METHYL-4-NITROQUINOLINE N-OXIDE

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