Basic information
- Standard SMILES
O=S(=O)(O)c1cc(O)c2c(Br)cc(S(=O)(=O)O)cc2c1- InChIKey
CNAKQGRRXFEXRQ-UHFFFAOYSA-N- Molecular formula
- C10H7BrO7S2
- Average molar mass
- 383.2 g/mol
Names & identifiers
- Preferred name
- 1-Bromo-8-hydroxynaphthalene-3,6-disulfonic acid
- IUPAC
- 4-bromo-5-hydroxynaphthalene-2,7-disulfonic acid
Names & synonyms
1-bromo-8-hydroxynaphthalene-3,6-disulfonic acidSCHEMBL4805849CNAKQGRRXFEXRQ-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 85519890
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 561
Related reactions
2 records
Linked notes
Loading…