Basic information
- CAS
52659-19-5- Standard SMILES
O=C(O)C(=O)O.c1c[nH]cn1- InChIKey
GPUZWNNASIXLTQ-UHFFFAOYSA-N- Molecular formula
- C5H6N2O4
- Average molar mass
- 158.11 g/mol
- Monoisotopic mass
- 158.03275668
Names & identifiers
- Preferred name
- Imidazole oxalate
- IUPAC
- 1H-imidazole;oxalic acid
Names & synonyms
imidazole oxalate1H-Imidazole, ethanedioateSCHEMBL7766522DTXSID80138033252659-19-5
Database identifiers
- CAS
52659-19-5- PubChem CID
- 19829572
- DTXSID
DTXSID801380332
Properties
Computed structural properties
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 99.6
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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