4-(4-carboxy-1,2,5-oxadiazol-3-yl)-1,2,5-oxadiazole-3-carboxylic Acid Hydrate

Base Information

• Chemical Name: 4-(4-carboxy-1,2,5-oxadiazol-3-yl)-1,2,5-oxadiazole-3-carboxylic Acid Hydrate
• CAS No.: 306935-61-5
• Molecular Formula: C6H2 N4 O6 . H2 O
• Molecular Weight: 244.12
• DSSTox Substance ID: DTXSID80369586
• Mol file: 306935-61-5.mol

Synonyms:306935-61-5;3,3'-Dicarboxy-4,4'-difurazan hydrate;4-(4-carboxy-1,2,5-oxadiazol-3-yl)-1,2,5-oxadiazole-3-carboxylic Acid Hydrate;[3,3'-Bi(1,2,5-oxadiazole)]-4,4'-dicarboxylic acid hydrate;4-(4-carboxy-1,2,5-oxadiazol-3-yl)-1,2,5-oxadiazole-3-carboxylic acid;hydrate;HMS561O01;DTXSID80369586;AKOS030508118;FT-0614044;[3,3'-Bi(1,2,5-oxadiazole)]-4,4'-dicarboxylicacidhydrate;3,3'-bi(1,2,5-oxadiazole)-4,4'-dicarboxylic acid hydrate

Chemical Property of 4-(4-carboxy-1,2,5-oxadiazol-3-yl)-1,2,5-oxadiazole-3-carboxylic Acid Hydrate

Chemical Property:

• Melting Point: 182-184
• PSA: 161.67000
• LogP: -0.54830
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 3
• Exact Mass: 244.00799848
• Heavy Atom Count: 17
• Complexity: 281

Purity/Quality:

98%min ^*data from raw suppliers

4,4'-DIFURAZAN-3,3'-DICARBOXYLIC ACID HYDRATE 95.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1(=NON=C1C(=O)O)C2=NON=C2C(=O)O.O