Basic information
- CAS
1414456-41-9- Standard SMILES
CC(C)Oc1ncc(B2OC(C)(C)C(C)(C)O2)cc1N- InChIKey
BBRTUJXRVMSWCU-UHFFFAOYSA-N- Molecular formula
- C14H23BN2O3
- Average molar mass
- 278.16 g/mol
- Monoisotopic mass
- 278.1801728
Names & identifiers
- Preferred name
- 2-Isopropoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-amine
- IUPAC
- 2-propan-2-yloxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-amine
Names & synonyms
1414456-41-9SCHEMBL13975916DTXSID4011333292-Isopropoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-amine2-(1-Methylethoxy)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinamine2-[(Propan-2-yl)oxy]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-amine
Database identifiers
- CAS
1414456-41-9- PubChem CID
- 71041925
- DTXSID
DTXSID401133329
Properties
Computed structural properties
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 333
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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