Benzene-1,2,4,5-tetracarboxylic acid--1,10-phenanthroline (1/1)
Basic information
- CAS
925213-93-0- Standard SMILES
O=C(O)c1cc(C(=O)O)c(C(=O)O)cc1C(=O)O.c1cnc2c(c1)ccc1cccnc12- InChIKey
QEQZMJUNRBMLHX-UHFFFAOYSA-N- Molecular formula
- C22H14N2O8
- Average molar mass
- 434.4 g/mol
- Monoisotopic mass
- 434.07501541
Names & identifiers
- Preferred name
- Benzene-1,2,4,5-tetracarboxylic acid--1,10-phenanthroline (1/1)
- IUPAC
- benzene-1,2,4,5-tetracarboxylic acid;1,10-phenanthroline
Names & synonyms
925213-93-0DTXSID20854022Benzene-1,2,4,5-tetracarboxylic acid--1,10-phenanthroline (1/1)
Database identifiers
- CAS
925213-93-0- PubChem CID
- 71445482
- DTXSID
DTXSID20854022
Properties
Computed structural properties
- Topological polar surface area
- 175 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 509
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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