Basic information
- Standard SMILES
Cc1ccc2nc(C(=O)O)c(C(=O)O)nc2c1- InChIKey
HGYNHODPEWXLIH-UHFFFAOYSA-N- Molecular formula
- C11H8N2O4
- Average molar mass
- 232.19 g/mol
Names & identifiers
- Preferred name
- 6-Methylquinoxaline-2,3-dicarboxylic acid
- IUPAC
- 6-methylquinoxaline-2,3-dicarboxylic acid
- English name
- 6-Methylquinoxaline-2,3-dicarboxylic acid
- Molecular formula
- C11H8N2O4
- Molecular weight
- 232.19
Names & synonyms
6-methylquinoxaline-2,3-dicarboxylic acid143663-15-4MLS0001236686-Methyl-quinoxaline-2,3-dicarboxylic acidOprea1_032918Oprea1_221027SCHEMBL2806412CHEMBL1723853HMS1688I19HMS2482C21AKOS000626740CCG-114894
Show more names
2,3-Quinoxalinedicarboxylic acid, 6-methyl-
6-methylquinoxaline-2,3-dicarboxylicacidSMR0001242956-methyl-2,3-quinoxalinedicarboxylic acidST50277916AN-465/14526003
Database identifiers
- CAS
143663-15-4- ChEMBL
CHEMBL1723853
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 333
Physicochemical properties
- Boiling point
- 439.4 · 439.4±45.0 °C(Predicted)
- Density
- 1.534 · 1.534±0.06 g/cm3(Predicted)
- pka
- 1.73 · 1.73±0.30(Predicted)
Chemistry & industry
Suppliers2 total
ZERENEX[email protected]
PRINCETON[email protected]
Related reactions
0 records
No reaction records under the current filter.
Linked notes
Loading…