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Home > Boronic Acids > 1231934-47-6
1231934-47-6 | 3-Methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,4-triazolo[4,3-a]pyridine
CAS No: 1231934-47-6 Catalog No: AG00HH6W MDL No:
Product Description
Catalog Number:
AG00HH6W
Chemical Name:
3-Methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,4-triazolo[4,3-a]pyridine
CAS Number:
1231934-47-6
Molecular Formula:
C13H18BN3O2
Molecular Weight:
259.1119
IUPAC Name:
3-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine
InChI:
InChI=1S/C13H18BN3O2/c1-9-15-16-11-7-6-10(8-17(9)11)14-18-12(2,3)13(4,5)19-14/h6-8H,1-5H3
InChI Key:
RUGBGMBTPRKJJU-UHFFFAOYSA-N
SMILES:
Cc1nnc2n1cc(cc2)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.149g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.116g/mol
Monoisotopic Mass:
259.149g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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