N-Phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)-5-(trifluoromethyl) aniline
Basic information
- CAS
651014-86-7- Standard SMILES
CC1(C)OB(c2cc(Nc3ccccc3)cc(C(F)(F)F)c2)OC1(C)C- InChIKey
UKXXDQYIGLFRFO-UHFFFAOYSA-N- Molecular formula
- C19H21BF3NO2
- Average molar mass
- 363.2 g/mol
- Monoisotopic mass
- 363.1617436
Names & identifiers
- Preferred name
- N-Phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)-5-(trifluoromethyl) aniline
- IUPAC
- N-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)aniline
Names & synonyms
N-PHENYL-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-5-(TRIFLUOROMETHYL) ANILINE651014-86-7N-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)anilineDTXSID50701151
Database identifiers
- CAS
651014-86-7- PubChem CID
- 53437795
- DTXSID
DTXSID50701151- Nikkaji
- J2.304.931G
Properties
Computed structural properties
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 476
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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