Basic information
- Standard SMILES
Cc1c(B2OC(C)(C)C(C)(C)O2)ccc(F)c1N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C- InChIKey
FRXBELPZRBLMOZ-UHFFFAOYSA-N- Molecular formula
- C23H35BFNO6
- Average molar mass
- 451.3 g/mol
Names & identifiers
- Preferred name
- [3-(Di-Boc-amino)-4-fluoro-2-methylphenyl]boronic Acid Pinacol Ester
- IUPAC
- tert-butyl N-[6-fluoro-2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
Names & synonyms
1427407-15-5SCHEMBL14786546FRXBELPZRBLMOZ-UHFFFAOYSA-NSY420442[3-(Di-Boc-amino)-4-fluoro-2-methylphenyl]boronic Acid Pinacol EsterDi-tert-butyl (6-fluoro-2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)iminodicarbonateTert-butyl N-tert-butoxycarbonyl-N-[6-fluoro-2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate
Database identifiers
- PubChem CID
- 89445558
Properties
Computed structural properties
- Topological polar surface area
- 74.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 670
Related reactions
1 records
Compound notes
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