Basic information
- CAS
919119-61-2- Standard SMILES
COc1cc(B2OC(C)(C)C(C)(C)O2)c2[nH]c(C)cc2c1- InChIKey
AAUQGODVSUVOLU-UHFFFAOYSA-N- Molecular formula
- C16H22BNO3
- Average molar mass
- 287.2 g/mol
- Monoisotopic mass
- 287.1692737
Names & identifiers
- Preferred name
- 5-Methoxy-2-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole
- IUPAC
- 5-methoxy-2-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole
- English name
- 5-Methoxy-2-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole
- Molecular formula
- C16H22BNO3
- Molecular weight
- 0
Names & synonyms
5-METHOXY-2-METHYL-7-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-INDOLE919119-61-2DTXSID90648076RefChem:303758DTXCID50598826
Database identifiers
- CAS
919119-61-2- PubChem CID
- 24960596
- DTXSID
DTXSID90648076- Nikkaji
- J2.406.487E
Properties
Computed structural properties
- Topological polar surface area
- 43.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 385
Related reactions
1 records
Compound notes
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