3-Nitroperoxybenzoic acid
3-nitrobenzenecarboperoxoic acid
Also Known As: m-Nitroperoxybenzoic acid|3-Nitroperoxybenzoic acid|meta-nitroperbenzoic acid|3-Nitrobenzenecarboperoxoic acid|meta-Nitroperoxybenzoic acid|3-nitroperbenzoic acid|3-nitrobenzene-1-carboperoxoic acid|Benzenecarboperoxoicacid, 3-nitro-|J2.393.609G
CAS: 2453-41-0
| Molecular Formula | C7H5NO5 |
|---|---|
| Molecular Weight | 183.01677 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.01677 |
| Monoisotopic Mass | 183.01677 |
| Heavy Atoms | 13 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 2453-41-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OO |
| InChIKey | OQOXQGCYFYSFRH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (22 patents)
Organic Building Blocks (5 patents)
Organometallic Reagents (2 patents)
Peptides & Amino Acids (2 patents)
Pharmaceutical Intermediates (29 patents)
Polymer Intermediates (21 patents)
Product Overview
3-Nitroperoxybenzoic acid (CAS 2453-41-0), with molecular formula C7H5NO5 and molecular weight 183.01677 g/mol. IUPAC: 3-nitrobenzenecarboperoxoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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