1,3,4,6-Pentalenetetracarboxylic acid, octahydro-

Base Information

• Chemical Name: 1,3,4,6-Pentalenetetracarboxylic acid, octahydro-
• CAS No.: 91498-16-7
• Molecular Formula: C12H14O8
• Molecular Weight: 286.23500
• DSSTox Substance ID: DTXSID70446577
• Nikkaji Number: J2.942.576K
• Mol file: 91498-16-7.mol

Synonyms:91498-16-7;1,3,4,6-Pentalenetetracarboxylic acid, octahydro-;SCHEMBL66017;SCHEMBL14647772;DTXSID70446577;Octahydropentalene-1,3,4,6-tetracarboxylic acid

Chemical Property of 1,3,4,6-Pentalenetetracarboxylic acid, octahydro-

Chemical Property:

• Melting Point: 263-264 °C (decomp)
• Boiling Point: 480.8±45.0 °C(Predicted)
• PSA: 149.20000
• Density: 1.664±0.06 g/cm3(Predicted)
• LogP: -0.17060
• XLogP3: -0.9
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 286.06886740
• Heavy Atom Count: 20
• Complexity: 400

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C2C(CC(C2C1C(=O)O)C(=O)O)C(=O)O)C(=O)O