6-Nitro-1,2-benzisoxazole-3-carboxylic acid (1-)

Base Information

• Chemical Name: 6-Nitro-1,2-benzisoxazole-3-carboxylic acid (1-)
• CAS No.: 42540-91-0
• Molecular Formula: C8H3N2O5-
• Molecular Weight: 207.1204
• DSSTox Substance ID: DTXSID10195335
• Wikidata: Q83068225
• Mol file: 42540-91-0.mol

Synonyms:6-NITRO-1,2-BENZISOXAZOLE-3-CARBOXYLIC ACID (1-);42540-91-0;SCHEMBL492851;DTXSID10195335

Chemical Property of 6-Nitro-1,2-benzisoxazole-3-carboxylic acid (1-)

Chemical Property:

• Vapor Pressure: 3.4E-10mmHg at 25°C
• Boiling Point: 484.4°C at 760 mmHg
• Flash Point: 246.8°C
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 207.00419620
• Heavy Atom Count: 15
• Complexity: 284

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1[N+](=O)[O-])ON=C2C(=O)[O-]

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