6-Nitro-2-phenylbenzotriazol-1-oxide structure

6-Nitro-2-phenylbenzotriazol-1-oxide

6-nitro-1-oxido-2-phenylbenzotriazol-1-ium

Also Known As: 6-nitro-2-phenylbenzotriazol-1-oxide|2H-Benzotriazole, 5-nitro-2-phenyl-, 3-oxide|5-nitro-2-phenyl-2H-benzotriazole 3-oxide|6-nitro-1-oxido-2-phenylbenzotriazol-1-ium

CAS: 64264-32-0
Molecular Formula C12H8N4O3
Molecular Weight 256.05963 g/mol
LogP 3.4
Topological Polar Surface Area 89.1 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 1
Exact Mass 256.05963
Monoisotopic Mass 256.05963
Heavy Atoms 19
Complexity 342.0

Chemical Identifiers

CAS Number 64264-32-0
SMILES C1=CC=C(C=C1)N2N=C3C=CC(=CC3=[N+]2[O-])[N+](=O)[O-]
InChIKey KFUBVSOWWBALKS-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Organic Building Blocks (4 patents) Paper Chemicals (3 patents)

Product Overview

6-Nitro-2-phenylbenzotriazol-1-oxide (CAS 64264-32-0), with molecular formula C12H8N4O3 and molecular weight 256.05963 g/mol. IUPAC: 6-nitro-1-oxido-2-phenylbenzotriazol-1-ium.

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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.
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