2,4,5-Tribromo-1-(4-chlorobenzoyl)imidazole
Basic information
- CAS
15287-32-8- Standard SMILES
O=C(c1ccc(Cl)cc1)n1c(Br)nc(Br)c1Br- InChIKey
OTPRLPCKQDZVGR-UHFFFAOYSA-N- Molecular formula
- C10H4Br3ClN2O
- Average molar mass
- 443.31 g/mol
- Monoisotopic mass
- 439.75623
Overview
2,4,5-Tribromo-1-(4-chlorobenzoyl)imidazole is an organohalogen compound and a carbonyl compound.
Names & identifiers
- Preferred name
- 2,4,5-Tribromo-1-(4-chlorobenzoyl)imidazole
- IUPAC
- (4-chlorophenyl)-(2,4,5-tribromoimidazol-1-yl)methanone
- English name
- 2,4,5-Tribromo-1-(p-chlorobenzoyl)-midazole
- Molecular formula
- C10H4Br3ClN2O
- Molecular weight
- 443.32
Names & synonyms
15287-32-82,4,5-Tribromo-1-(p-chlorobenzoyl)-midazole2,4,5-TRIBROMO-1-(4-CHLOROBENZOYL)IMIDAZOLE(4-chlorophenyl)-(2,4,5-tribromoimidazol-1-yl)methanoneC11128AC1L1CO7SureCN9776775CHEBI:8941H-Imidazoloe, 2,4,5-tribromo-1-(4-chlorobenzoyl)-SCHEMBL9776775DTXSID70934621DB-083103
Show more names
Methanone, (4-chlorophenyl)(2,4,5-tribromo-1H-imidazol-1-yl)-
Q27105376(4-chlorophenyl)(2,4,5-tribromo-1H-imidazol-1-yl)methanone
Database identifiers
- CAS
15287-32-8- PubChem CID
- 27183
- DTXSID
DTXSID70934621- ChEBI
CHEBI:894- Nikkaji
- J1.567.258G
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 299
Physicochemical properties
- Melting point
- 129 · 129-130 °C
- Boiling point
- 533 · 533.0±60.0 °C(Predicted)
- Density
- 2.25 · 2.25±0.1 g/cm3(Predicted)
- pka
- -4.99 · -4.99±0.60(Predicted)
Chemistry & industry
Additional notes
DefinitionChEBI: 2,4,5-Tribromo-1-(4-chlorobenzoyl)imidazole is a carbonyl compound and an organohalogen compound.
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Compound notes
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