1-(4-Bromophenyl)-1,2-dihydro-3,6-pyridazinedione
Basic information
- CAS
5435-32-5- Standard SMILES
O=c1ccc(=O)n(-c2ccc(Br)cc2)[nH]1- InChIKey
DXIIPXGVMBOYRP-UHFFFAOYSA-N- Molecular formula
- C10H7BrN2O2
- Average molar mass
- 267.08 g/mol
- Monoisotopic mass
- 265.96909
Names & identifiers
- Preferred name
- 1-(4-Bromophenyl)-1,2-dihydro-3,6-pyridazinedione
- IUPAC
- 2-(4-bromophenyl)-1H-pyridazine-3,6-dione
- English name
- 1-(4-bromophenyl)-2H-pyridazine-3,6-dione
- Molecular formula
- C10H7BrN2O2
- Molecular weight
- 267.08
Names & synonyms
5435-32-51-(4-Bromophenyl)-1,2-dihydro-3,6-pyridazinedioneNSC 21419DTXSID80202727RefChem:224866DTXCID101252181-(4-bromophenyl)-1,2-dihydropyridazine-3,6-dione2-(4-bromophenyl)-1H-pyridazine-3,6-dioneNSC21419NSC-21419LWW322AH5GOprea1_319775
Show more names
1-(4-bromophenyl)-2H-pyridazine-3,6-dione3,6-Pyridazinedione, 1-(4-bromophenyl)-1,2-dihydro-
Oprea1_820951DXIIPXGVMBOYRP-UHFFFAOYSA-NMFCD01839101AKOS024281029ST037338SY357320DS-008046AB00075916-01
Database identifiers
- CAS
5435-32-5- PubChem CID
- 228465
- DTXSID
DTXSID80202727- UNII
- LWW322AH5G
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 309
Physicochemical properties
- FDA UNII
- 322 AH5G · LWW322AH5G
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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