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Basic information
- Standard SMILES
Nc1cc2[nH]c(=O)c(=O)[nH]c2cc1[N+](=O)[O-]- InChIKey
BXVBIXMPDPFPLK-UHFFFAOYSA-N- Molecular formula
- C8H6N4O4
- Average molar mass
- 222.16 g/mol
- Monoisotopic mass
- 222.03890469
Names & identifiers
- Preferred name
- 6-Amino-7-nitroquinoxaline-2,3-diol
- IUPAC
- 6-amino-7-nitro-1,4-dihydroquinoxaline-2,3-dione
Names & synonyms
Oprea1_846441SCHEMBL6109752SCHEMBL7482757BXVBIXMPDPFPLK-UHFFFAOYSA-N6-amino-7-nitroquinoxaline-2,3-diolAKOS024363829ST509954206-amino-7-nitro-2,3(1H,4H)-quinoxalinedione6-amino-7-nitroquinoxaline-2,3(1H,4H)-dione
Database identifiers
- PubChem CID
- 3980992
Properties
Computed structural propertiesFilling in
- XLogP
- 0.1
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 352
Related reactions
9 records
Compound notes
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