Flubendazole EP Impurity C
Basic information
- CAS
1097107-40-8- Standard SMILES
O=C(c1ccc(F)cc1)c1ccc2[nH]c(=O)[nH]c2c1- InChIKey
DQWBRTHPRMPYTA-UHFFFAOYSA-N- Molecular formula
- C14H9FN2O2
- Average molar mass
- 256.23 g/mol
- Monoisotopic mass
- 256.0648057
Names & identifiers
- Preferred name
- Flubendazole EP Impurity C
- IUPAC
- 5-(4-fluorobenzoyl)-1,3-dihydrobenzimidazol-2-one
- English name
- (4-Fluorophenyl)(2-hydroxy-1H-benzi
- Molecular formula
- C14H9FN2O2
- Molecular weight
- 256.23
Names & synonyms
1097107-40-8Flubendazole EP Impurity C(4-Fluorophenyl)(2-hydroxy-1H-benzi(4-fluorophenyl)(2-hydroxy-1H-benzo[d]imidazol-5-yl)methanone(4-Fluorophenyl)(2-hydroxy-1H-benzimidazol-5-yl)methanone; Flubendazole Imp. C (EP); Flubendazole Impurity CFlubendazole Impurity CFlubendazole Impurity 2Flubendazole Impurity 9 (Flubendazole EP Impurity C)2H-Benzimidazol-2-one, 5-(4-fluorobenzoyl)-1,3-dihydro-(4-Fluorophenyl)(2-hydroxy- 1H-benzimidazol-5-yl)methanone
Database identifiers
- CAS
1097107-40-8- PubChem CID
- 43338680
- EC Number
- 642-107-0
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 380
Physicochemical properties
- Boiling point
- 328.5 · 328.5±35.0 °C(Predicted)
- Density
- 1.352 · 1.352±0.06 g/cm3(Predicted)
- pka
- 11.45 · 11.45±0.30(Predicted)
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, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
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Related reactions
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Compound notes
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