4,5-Bis-(4-bromo-phenyl)-1,3-dihydro-imidazol-2-one
Basic information
- CAS
123714-75-0- Standard SMILES
O=c1[nH]c(-c2ccc(Br)cc2)c(-c2ccc(Br)cc2)[nH]1- InChIKey
JJOLJNZIRYMBPU-UHFFFAOYSA-N- Molecular formula
- C15H10Br2N2O
- Average molar mass
- 394.06 g/mol
- Monoisotopic mass
- 391.91599
Names & identifiers
- Preferred name
- 4,5-Bis-(4-bromo-phenyl)-1,3-dihydro-imidazol-2-one
- IUPAC
- 4,5-bis(4-bromophenyl)-1,3-dihydroimidazol-2-one
- English name
- 4,5-Bis-(4-bromo-phenyl)-1,3-dihydro-imidazol-2-one
- Molecular formula
- C15H10Br2N2O
- Molecular weight
- 394.06
Names & synonyms
123714-75-0RefChem:5076014,5-bis-(4-bromo-phenyl)-1,3-dihydro-imidazol-2-one651-696-34,5-Bis(4-bromophenyl)-1H-imidazol-2(3H)-oneAKOS0243223514,5-bis(4-bromophenyl)-1,3-dihydro-2H-imidazol-2-one2H-Imidazol-2-one, 4,5-bis(4-bromophenyl)-1,3-dihydro-
Database identifiers
- CAS
123714-75-0- PubChem CID
- 4655705
- EC Number
- 651-696-3
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 372
Physicochemical properties
- Density
- 1.733 · 1.733±0.06 g/cm3(Predicted)
- pka
- 10.67 · 10.67±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H413-H319
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H413-H319
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
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Related reactions
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Compound notes
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