| CAS Number | 1234319-13-1 |
| Catalog Number | AG01BHH4 |
| Chemical Name | 2-[4-(Fluoromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| IUPAC Name | 2-[4-(fluoromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI | InChI=1S/C13H18BFO2/c1-12(2)13(3,4)17-14(16-12)11-7-5-10(9-15)6-8-11/h5-8H,9H2,1-4H3 |
| InChI Key | OFYNCXMIUNHOFP-UHFFFAOYSA-N |
| MDL Number | MFCD22493522 |
| Molecular Formula | C13H18BFO2 |
| Molecular Weight | 236.0902 |
| SMILES | CC1(C(C)(C)OB(C2=CC=C(CF)C=C2)O1)C |
| Synonyms | 2-[4-(fluoromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,
1234319-13-1,
SCHEMBL2574495,
OFYNCXMIUNHOFP-UHFFFAOYSA-N,
ZINC204323015,
2-(4-fluoromethyl-phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,
|
| Complexity | 257 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 236.138g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 236.093g/mol |
| Monoisotopic Mass | 236.138g/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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