Basic information
- Standard SMILES
O=C(O)Cn1ncc(Br)c(Br)c1=O- InChIKey
YSLPYSMTLPLFPW-UHFFFAOYSA-N- Molecular formula
- C6H4Br2N2O3
- Average molar mass
- 311.92 g/mol
- Monoisotopic mass
- 309.85887
Names & identifiers
- Preferred name
- 2-(4,5-Dibromo-6-oxopyridazin-1(6H)-yl)acetic acid
- IUPAC
- 2-(4,5-dibromo-6-oxopyridazin-1-yl)acetic acid
Names & synonyms
SCHEMBL2888709YSLPYSMTLPLFPW-UHFFFAOYSA-N2-(4,5-Dibromo-6-oxopyridazin-1(6H)-yl)acetic acid
Database identifiers
- PubChem CID
- 59574142
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 70 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 324
Related reactions
4 records
Compound notes
Loading…