Basic information
- Standard SMILES
CC1(C)COB(c2cc3cc[nH]c3cc2Cl)OC1- InChIKey
GVGCSICVOXCUAF-UHFFFAOYSA-N- Molecular formula
- C13H15BClNO2
- Average molar mass
- 263.53 g/mol
Names & identifiers
- Preferred name
- 6-chloro-5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-1H-indole
- IUPAC
- 6-chloro-5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-1H-indole
Names & synonyms
6-chloro-5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-1H-indole1467061-15-9SCHEMBL15301069GVGCSICVOXCUAF-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 86698733
Properties
Computed structural properties
- Topological polar surface area
- 34.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 305
Related reactions
45 records
Compound notes
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