| CAS Number | 1310949-75-7 |
| Catalog Number | AG01BIP9 |
| Chemical Name | 2-[4-(difluoromethyl)-3-fluorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| IUPAC Name | 2-[4-(difluoromethyl)-3-fluorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI | InChI=1S/C13H16BF3O2/c1-12(2)13(3,4)19-14(18-12)8-5-6-9(11(16)17)10(15)7-8/h5-7,11H,1-4H3 |
| InChI Key | CTHDVQSPTKBIQC-UHFFFAOYSA-N |
| MDL Number | MFCD16996282 |
| Molecular Formula | C13H16BF3O2 |
| Molecular Weight | 272.0711 |
| SMILES | FC(C1=C(C=C(C=C1)B1OC(C(O1)(C)C)(C)C)F)F |
| Synonyms | 2-(4-(DIFLUOROMETHYL)-3-FLUOROPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE,
1310949-75-7,
2-[4-(difluoromethyl)-3-fluorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,
SCHEMBL252903,
CTHDVQSPTKBIQC-UHFFFAOYSA-N,
MB20390,
AS-37296,
|
| Complexity | 320 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 272.12g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 272.074g/mol |
| Monoisotopic Mass | 272.12g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number