2,6-Dihydroxy-4-methyl-3,5-dinitrosobenzoic acid

Base Information

• Chemical Name: 2,6-Dihydroxy-4-methyl-3,5-dinitrosobenzoic acid
• CAS No.: 63980-10-9
• Molecular Formula: C8H6 N2 O6
• Molecular Weight: 226.143
• DSSTox Substance ID: DTXSID10981573
• Nikkaji Number: J85.060H
• Wikidata: Q82967959
• Mol file: 63980-10-9.mol

Synonyms:2,6-Dihydroxy-4-methyl-3,5-dinitrosobenzoic acid;63980-10-9;p-Toluic acid, 2,6-dihydroxy-3,5-dinitroso-;Benzoic acid, 2,6-dihydroxy-3,5-dinitroso-4-methyl-;DTXSID10981573

Chemical Property of 2,6-Dihydroxy-4-methyl-3,5-dinitrosobenzoic acid

Chemical Property:

• Vapor Pressure: 1.56E-15mmHg at 25°C
• Boiling Point: 605.9°Cat760mmHg
• Flash Point: 320.2°C
• Density: 1.8g/cm³
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 1
• Exact Mass: 226.02258592
• Heavy Atom Count: 16
• Complexity: 287

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C(=C(C(=C1N=O)O)C(=O)O)O)N=O