| CAS Number | 1079402-24-6 |
| Catalog Number | AG01B77I |
| Chemical Name | 4,4,5,5-tetramethyl-2-[2-(2,2,2-trifluoroethyl)phenyl]-1,3,2-dioxaborolane |
| IUPAC Name | 4,4,5,5-tetramethyl-2-[2-(2,2,2-trifluoroethyl)phenyl]-1,3,2-dioxaborolane |
| InChI | InChI=1S/C14H18BF3O2/c1-12(2)13(3,4)20-15(19-12)11-8-6-5-7-10(11)9-14(16,17)18/h5-8H,9H2,1-4H3 |
| InChI Key | VCDXTAOKTGFVNM-UHFFFAOYSA-N |
| MDL Number | MFCD18734058 |
| Molecular Formula | C14H18BF3O2 |
| Molecular Weight | 286.0977 |
| SMILES | FC(F)(F)CC1=CC=CC=C1B2OC(C)(C)C(C)(C)O2 |
| Synonyms | 4,4,5,5-tetramethyl-2-[2-(2,2,2-trifluoroethyl)phenyl]-1,3,2-dioxaborolane,
1079402-24-6,
SCHEMBL261662,
VCDXTAOKTGFVNM-UHFFFAOYSA-N,
ZINC200257916,
4,4,5,5-tetramethyl-2-[2-(2,2,2-trifluoroethyl)-phenyl]-[1,3,2]dioxaborolane,
|
| Complexity | 339 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 286.135g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 286.101g/mol |
| Monoisotopic Mass | 286.135g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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