2-(Boc-methylamino)pyridine-4-boronic acid pinacol ester - CAS 1254381-09-3
Catalog: |
BB072523 |
Product Name: |
2-(Boc-methylamino)pyridine-4-boronic acid pinacol ester |
CAS: |
1254381-09-3 |
Synonyms: |
tert-butyl methyl(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)carbamate; 2-(Boc-methylamino)pyridine-4-boronic acid pinacol ester; TERT-BUTYL N-METHYL-N-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-2-YL]CARBAMATE |
IUPAC Name: | tert-butyl N-methyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]carbamate |
Description: | 2-(Boc-methylamino)pyridine-4-boronic acid pinacol ester |
Molecular Weight: | 334.22 |
Molecular Formula: | C17H27BN2O4 |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC(=NC=C2)N(C)C(=O)OC(C)(C)C |
InChI: | InChI=1S/C17H27BN2O4/c1-15(2,3)22-14(21)20(8)13-11-12(9-10-19-13)18-23-16(4,5)17(6,7)24-18/h9-11H,1-8H3 |
InChI Key: | PJGLMYXULHFDKP-UHFFFAOYSA-N |
Complexity: | 460 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 334.2063875 |
Formal Charge: | 0 |
Heavy Atom Count: | 24 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 334.2063875 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 60.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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