NITROBENZENE Next Previous

ChEMBL ID CHEMBL15750
PubChem CID 7416
DrugBank Accession Number
ClinicalTrials NITROBENZENE
Molecular Formula C6H5NO2
Inchikey LQNUZADURLCDLV-UHFFFAOYSA-N

Smiles
[O-][N+](=O)c1ccccc1

Synonyms
Nitro-Benzene, SID26752996, Nitrobenzene, SID17389793, 1-Nitrobenzene

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts
Passes of Rule of 3
Rule of 5 Violations 0
Molecular Species
Molecular Properties
Molecular Weight 123.11
Rotatable Bonds 1
Acidic pKa (ACD) -
Basic pKa (ACD) -
LogP (ACD) 1.92
LogD (ACD) 1.92
ALogP 1.72
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