Nitrobenzene


Nitrobenzene
DEDuCT identifierDED000147
Pubchem identifier7416
CAS identifier98-95-3
IUPAC nameNitrobenzene
Category based on type of supporting evidenceCategory III
Broad category based on environmental sourceMedicine and Healthcare, Agriculture and Farming, Consumer Products, Industry
Sub-category based on environmental sourceDrugs and Pharmaceuticals, Fertilizer, Household Supplies, Lubricants, Paints, Personal and Healthcare Products, Pesticide, Photography, Stationery
Chemical kingdomOrganic compounds
Chemical super-classBenzenoids
Chemical classBenzene and substituted derivatives
SMILESC1=CC=C(C=C1)[N+](=O)[O-]
InChIInChI=1S/C6H5NO2/c8-7(9)6-4-2-1-3-5-6/h1-5H
InChIKeyLQNUZADURLCDLV-UHFFFAOYSA-N

Download structure:
2D:2D MOL2D MOL22D SDF
3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT

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