| CAS Number | 1423123-94-7 |
| Catalog Number | AG00HWH8(AGN-PC-0WAJYA) |
| Chemical Name | 1-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)-1H-1,2,3-triazole |
| IUPAC Name | 1-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)triazole |
| InChI | InChI=1S/C9H16BN3O2/c1-8(2)9(3,4)15-10(14-8)7-6-13(5)12-11-7/h6H,1-5H3 |
| InChI Key | JRZQTIYNOZRXEG-UHFFFAOYSA-N |
| MDL Number | MFCD13190015 |
| Molecular Formula | C9H16BN3O2 |
| Molecular Weight | 209.0532 |
| SMILES | N1=NN(C=C1B2OC(C)(C)C(O2)(C)C)C |
| Synonyms | 1423123-94-7,
1-METHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-1,2,3-TRIAZOLE,
1-Methyl-1H-1,2,3-triazole-4-boronic acid pinacol ester,
ZINC206057150,
AB69587,
DA-10415,
FT-0734609,
|
| Complexity | 244 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.134g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.056g/mol |
| Monoisotopic Mass | 209.134g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 49.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number