6-(Hydroxy(oxido)amino)-2,1-benzisoxazole-3-carboxylic acid structure

6-(Hydroxy(oxido)amino)-2,1-benzisoxazole-3-carboxylic acid

6-nitro-2,1-benzoxazole-3-carboxylic acid

Also Known As: 6-nitro-2,1-benzoxazole-3-carboxylic acid|6-(Hydroxy(oxido)amino)-2,1-benzisoxazole-3-carboxylic acid|6-Nitrobenzo[c]isoxazole-3-carboxylic acid|6-Nitro-2,1-benzisoxazole-3-carboxylic acid|6-nitro-benzo[c]isoxazole-3-carboxylic acid|2,1-Benzisoxazole-3-carboxylicacid, 6-nitro-|2,1-Benzisoxazole-3-carboxylic acid, 6-nitro-

CAS: 6501-77-5
Molecular Formula C8H4N2O5
Molecular Weight 208.01202 g/mol
LogP 1.4
Topological Polar Surface Area 109.0 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 1
Exact Mass 208.01202
Monoisotopic Mass 208.01202
Heavy Atoms 15
Complexity 289.0

Chemical Identifiers

CAS Number 6501-77-5
SMILES C1=CC2=C(ON=C2C=C1[N+](=O)[O-])C(=O)O
InChIKey LIZZRGKWWBTAKX-UHFFFAOYSA-N

Product Overview

6-(Hydroxy(oxido)amino)-2,1-benzisoxazole-3-carboxylic acid (CAS 6501-77-5), with molecular formula C8H4N2O5 and molecular weight 208.01202 g/mol. IUPAC: 6-nitro-2,1-benzoxazole-3-carboxylic acid.

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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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