| CAS Number | 949115-04-2 |
| Catalog Number | AG01EHXL |
| Chemical Name | 1H-Pyrrole, 1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- |
| IUPAC Name | 1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyrrole |
| InChI | InChI=1S/C16H20BNO2/c1-15(2)16(3,4)20-17(19-15)13-7-9-14(10-8-13)18-11-5-6-12-18/h5-12H,1-4H3 |
| InChI Key | LIGABBLKQSAQMD-UHFFFAOYSA-N |
| MDL Number | MFCD22415357 |
| Molecular Formula | C16H20BNO2 |
| Molecular Weight | 269.1465 |
| SMILES | CC1(C)OB(OC1(C)C)c1ccc(cc1)n1cccc1 |
| Synonyms | 1-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-pyrrole,
949115-04-2,
AS-55459,
2-[4-(1H-Pyrrole-1-yl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,
|
| Complexity | 328 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 269.159g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 269.151g/mol |
| Monoisotopic Mass | 269.159g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 23.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number