2,3-Dimethyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyrimidine
Basic information
- CAS
1111638-08-4- Standard SMILES
Cc1nc2ncc(B3OC(C)(C)C(C)(C)O3)cn2c1C- InChIKey
BHRVIUPYDDNZCA-UHFFFAOYSA-N- Molecular formula
- C14H20BN3O2
- Average molar mass
- 273.14 g/mol
- Monoisotopic mass
- 273.1648571
Names & identifiers
- Preferred name
- 2,3-Dimethyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyrimidine
- IUPAC
- 2,3-dimethyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyrimidine
- English name
- IMidazo[1,2-a]pyriMidine, 2,3-diMethyl-6-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-
- Molecular formula
- C14H20BN3O2
- Molecular weight
- 273.14
Names & synonyms
1111638-08-42,3-dimethyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyrimidineIMidazo[1,2-a]pyriMidine, 2,3-diMethyl-6-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-MFCD17012682SCHEMBL2960542DTXSID601129291AKOS015950167DB-0843682,3-Dimethylimidazo[1,2-a]pyrimidine-6-boronic acid pinacol ester
Database identifiers
- CAS
1111638-08-4- PubChem CID
- 53398640
- DTXSID
DTXSID601129291
Properties
Computed structural properties
- Topological polar surface area
- 48.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 375
Physicochemical properties
- Density
- 1.15 · 1.15±0.1 g/cm3(Predicted)
- pka
- 7.06 · 7.06±0.30(Predicted)
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Related reactions
1 records
Compound notes
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