Bromopyrine
Basic information
- CAS
603-65-6- Standard SMILES
Cc1cc(=O)n(-c2ccc(Br)cc2)n1C- InChIKey
RYPXUXARNBYXCF-UHFFFAOYSA-N- Molecular formula
- C11H11BrN2O
- Average molar mass
- 267.12 g/mol
- Monoisotopic mass
- 266.00548
Names & identifiers
- Preferred name
- Bromopyrine
- IUPAC
- 2-(4-bromophenyl)-1,5-dimethylpyrazol-3-one
- English name
- 1,2-Dihydro-2-(4-bromophenyl)-1,5-dimethyl-3H-pyrazol-3-one
- Molecular formula
- C11H11BrN2O
- Molecular weight
- 267.12
Names & synonyms
BROMOPYRINE603-65-6SCHEMBL11005335DTXSID602090572-(4-Bromophenyl)-1,5-dimethyl-1,2-dihydro-3H-pyrazol-3-one1,2-Dihydro-2-(4-bromophenyl)-1,5-dimethyl-3H-pyrazol-3-one3H-Pyrazol-3-one, 2-(4-bromophenyl)-1,2-dihydro-1,5-dimethyl-
Database identifiers
- CAS
603-65-6- PubChem CID
- 11780
- DTXSID
DTXSID60209057- Nikkaji
- J94.958B
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 295
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…