Tert-butyl 5-bromo-4-hydroxyindoline-1-carboxylate
Basic information
- CAS
1092460-53-1- Standard SMILES
CC(C)(C)OC(=O)N1CCc2c1ccc(Br)c2O- InChIKey
QYERGTSMRWEZEL-UHFFFAOYSA-N- Molecular formula
- C13H16BrNO3
- Average molar mass
- 314.17 g/mol
- Monoisotopic mass
- 313.03136
Names & identifiers
- Preferred name
- Tert-butyl 5-bromo-4-hydroxyindoline-1-carboxylate
- IUPAC
- tert-butyl 5-bromo-4-hydroxy-2,3-dihydroindole-1-carboxylate
- English name
- 1H-Indole-1-carboxylicacid,5-broMo-2,3-dihydro-4-hydroxy-,1,1-diMethylethylester
- Molecular formula
- C13H16BrNO3
- Molecular weight
- 314.17
Names & synonyms
TERT-BUTYL 5-BROMO-4-HYDROXYINDOLINE-1-CARBOXYLATE1092460-53-1MFCD11501910tert-butyl 5-bromo-4-hydroxy-2,3-dihydroindole-1-carboxylateDTXSID50672857AR2825AKOS027253503SB64680AS-45453CS-0171764F306361tert-butyl 5-bromo-4-hydroxy-indoline-1-carboxylate
Show more names
1H-Indole-1-carboxylicacid,5-broMo-2,3-dihydro-4-hydroxy-,1,1-diMethylethylester
TERT-BUTYL5-BROMO-4-HYDROXYINDOLINE-1-CARBOXYLATEtert-Butyl 5-bromo-4-hydroxy-2,3-dihydro-1H-indole-1-carboxylate
Database identifiers
- CAS
1092460-53-1- PubChem CID
- 45926146
- DTXSID
DTXSID50672857
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 329
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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