Basic information
- Standard SMILES
Cc1cc2cc(Br)ccc2n1C(=O)OC(C)(C)C- InChIKey
IWZCHPDLIVYXIT-UHFFFAOYSA-N- Molecular formula
- C14H16BrNO2
- Average molar mass
- 310.19 g/mol
Names & identifiers
- Preferred name
- 5-Bromo-2-methyl-1-t-butyloxycarbonylindole
- IUPAC
- tert-butyl 5-bromo-2-methylindole-1-carboxylate
Names & synonyms
SCHEMBL1621434IWZCHPDLIVYXIT-UHFFFAOYSA-NDB-1550135-Bromo-2-methyl-1-t-butyloxycarbonylindole5-Bromo-2-methyl-1H-indole-1-carboxylic acid 1,1-dimethylethyl ester879887-22-6
Database identifiers
- PubChem CID
- 21865451
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 31.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 326
Related reactions
4 records
Compound notes
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