1-phenyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1H-benzo[d]imidazole
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Basic information
- CAS
1146340-38-6- Standard SMILES
CC1(C)OB(c2ccc(-c3nc4ccccc4n3-c3ccccc3)cc2)OC1(C)C- InChIKey
PEYQCEFPKMIOFP-UHFFFAOYSA-N- Molecular formula
- C25H25BN2O2
- Average molar mass
- 396.3 g/mol
- Monoisotopic mass
- 396.2009082
Names & identifiers
- Preferred name
- 1-phenyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1H-benzo[d]imidazole
- IUPAC
- 1-phenyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]benzimidazole
- English name
- 1 -phenyl-2-(4-(4,4,5,5-tetramethyl- 1 ,3,2-dioxaborolan-2-yl)phenyl)-1H-benzo[d]imidazole
- Molecular formula
- C25H25BN2O2
- Molecular weight
- 396.29
Names & synonyms
1146340-38-61-phenyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1H-benzo[d]imidazole1-Phenyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1H-benzo[d ]imidazole1-phenyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-phenyl]-1H-benzimidazole1-phenyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]benzimidazoleSCHEMBL348317SCHEMBL296027101 -phenyl-2-(4-(4,4,5,5-tetramethyl- 1 ,3,2-dioxaborolan-2-yl)phenyl)-1H-benzo[d]imidazoleDA-47765CS-0356870G86165F749682
Show more names
4 - (N-phenylbenzimidazole) phenylborate1-phenyl-2-(4-(4,4,5,5-tetramethyl-1,3,2- dioxaborolan-2-yl)phenyl)-1H-1-Phenyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1H-benzimidazole1H-Benzimidazole, 1-phenyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1-Phenylacetyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxin-2-yl)phenyl)-1H-benzoazole[D]Imidazole
1-Phenyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-benzimidazole1-phenyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1H -benzo[d]imidazole
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 36.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 582
Physicochemical properties
- Boiling point
- 564 · 564.0±52.0 °C(Predicted)
- Density
- 1.12 · 1.12±0.1 g/cm3(Predicted)
- pka
- 3.95 · 3.95±0.10(Predicted)
Related reactions
12 records
Compound notes
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