| CAS Number | 1700820-20-7 |
| Catalog Number | AG01BINQ |
| Chemical Name | 2-(3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)thiazole |
| IUPAC Name | 2-[3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]-1,3-thiazole |
| InChI | InChI=1S/C13H18BN3O2S/c1-9-10(8-17(16-9)11-15-6-7-20-11)14-18-12(2,3)13(4,5)19-14/h6-8H,1-5H3 |
| InChI Key | ROQNDSXQMZYKKJ-UHFFFAOYSA-N |
| MDL Number | MFCD27951756 |
| Molecular Formula | C13H18BN3O2S |
| Molecular Weight | 291.1769 |
| SMILES | CC1C(B2OC(C)(C)C(C)(C)O2)=CN(C2SC=CN=2)N=1 |
| Synonyms | 3-METHYL-1-(THIAZOL-2-YL)-1H-PYRAZOLE-4-BORONIC ACID PINACOL ESTER,
1700820-20-7,
|
| Complexity | 367 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 291.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 291.176g/mol |
| Monoisotopic Mass | 291.121g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 77.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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