Name | 4-Nitroquinoline-N-oxide |
Synonyms | 4-nqo nitrochin Nitroquinolineoxide TIMTEC-BB SBB006266 4-nitrochinolinn-oxid 4-nitroquinolineoxide 4-nitro-quinolin1-oxide 4-Nitroquinoline N-oxide 4-nitroquinoline 1-oxide 4-Nitroquinoline-N-oxide Quinoline, 4-nitro-, 1-oxide 4-nitrochinolinn-oxid(swedish) 4-nitro-1-oxo-1,8a-dihydroquinolinium |
CAS | 56-57-5 |
EINECS | 200-281-1 |
InChI | InChI=1/C9H7N2O3/c12-10-6-5-9(11(13)14)7-3-1-2-4-8(7)10/h1-6,8H/q+1 |
InChIKey | YHQDZJICGQWFHK-UHFFFAOYSA-N |
Molecular Formula | C9H6N2O3 |
Molar Mass | 190.16 |
Density | 1.42 |
Melting Point | 154-156°C(lit.) |
Boling Point | 325.64°C (rough estimate) |
Solubility | Solubility in water: . Solubility in other solvents: soluble in acetone, DMSO, DMF |
Appearance | Crystalline Solid |
Color | yellow to brown |
BRN | 165756 |
pKa | -1.83±0.10(Predicted) |
Storage Condition | -20°C |
Stability | Stable. Hygroscopic, light-sensitive. Incompatible with strong oxidizing agents. |
Refractive Index | 1.5570 (estimate) |
MDL | MFCD00006738 |
Use | for organic synthesis. |
Hazard Symbols | T - Toxic |
Risk Codes | R45 - May cause cancer R68 - Possible risk of irreversible effects R40 - Limited evidence of a carcinogenic effect R20/21/22 - Harmful by inhalation, in contact with skin and if swallowed. |
Safety Description | S53 - Avoid exposure - obtain special instructions before use. S45 - In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) S36/37 - Wear suitable protective clothing and gloves. S22 - Do not breathe dust. |
UN IDs | 2811 |
WGK Germany | 3 |
RTECS | VC2100000 |
HS Code | 29339900 |
Hazard Class | 6.1 |
Packing Group | II |
Toxicity | LD50 intraperitoneal in mouse: 190mg/kg |
EPA chemical substance information | information provided by: ofmpeb.epa.gov (external link) |
toxic substance data | information provided by: pubchem.ncbi.nlm.nih.gov (external link) |