5-Bromo-1-(tert-butyl)-1H-benzo[d]imidazole
Basic information
- CAS
1187386-22-6- Standard SMILES
CC(C)(C)n1cnc2cc(Br)ccc21- InChIKey
IILSCUZPOBADKX-UHFFFAOYSA-N- Molecular formula
- C11H13BrN2
- Average molar mass
- 253.14 g/mol
- Monoisotopic mass
- 252.02621
Names & identifiers
- Preferred name
- 5-Bromo-1-(tert-butyl)-1H-benzo[d]imidazole
- IUPAC
- 5-bromo-1-tert-butylbenzimidazole
- English name
- 5-Bromo-1-t-butylbenzo[d]imidazole
- Molecular formula
- C11H13BrN2
- Molecular weight
- 253.14
Names & synonyms
1187386-22-65-Bromo-1-(tert-butyl)-1H-benzo[d]imidazole5-Bromo-1-t-butylbenzo[d]imidazole5-bromo-1-tert-butylbenzimidazoleMFCD125465165-bromo-1-tert-butyl-1H-1,3-benzodiazole5-Bromo-1-tert-butylbenzo[d]imidazoleSCHEMBL16429379DTXSID60675192IILSCUZPOBADKX-UHFFFAOYSA-N5-bromo-1-tert-butyl-benzimidazoleAKOS015835901
Show more names
1H-Benzimidazole, 5-bromo-1-(1,1-dimethylethyl)-
5-Bromo-1-tert-butyl-1H-benzimidazoleAS-436065-Bromo-1-tert-butyl-1H-benzo[d]imidazoleDB-3406885-Bromo-1-tert-butyl-1H-1,3-benzimidazoleCS-0212538F212091
Database identifiers
- CAS
1187386-22-6- PubChem CID
- 46739596
- DTXSID
DTXSID60675192
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 17.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 212
Physicochemical properties
- form
- solid
- UNSPSC Code
- 12352200 · 12352200
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…