Basic information
- CAS
62947-11-9- Standard SMILES
CC1=NN(c2ccccc2)C(=O)C1(Br)Br- InChIKey
BEFNAEMDGAKHAR-UHFFFAOYSA-N- Molecular formula
- C10H8Br2N2O
- Average molar mass
- 331.99 g/mol
- Monoisotopic mass
- 329.90034
Names & identifiers
- Preferred name
- 4,4-Dibromo-5-methyl-2-phenyl-2,4-dihydro-3h-pyrazol-3-one
- IUPAC
- 4,4-dibromo-5-methyl-2-phenylpyrazol-3-one
Names & synonyms
4,4-dibromo-5-methyl-2-phenyl-2,4-dihydro-3h-pyrazol-3-one62947-11-9DTXSID60301429RefChem:284910DTXCID60252563NSC143333AKOS024384899NSC-143333DS-0146184-dibromo-3-methyl-1-phenyl-pyrazol-5-oneST510354254,4-Dibromo-5-methyl-2-phenyl-pyrazol-3-one
Show more names
4,4-dibromo-3-methyl-1-phenyl-2-pyrazolin-5-one
Database identifiers
- CAS
62947-11-9- PubChem CID
- 285802
- DTXSID
DTXSID60301429- Nikkaji
- J2.789.882C
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 309
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…