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Home > Boronic Acids > 1314137-24-0
1314137-24-0 | 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine
CAS No: 1314137-24-0 Catalog No: AG00A1I7 MDL No:MFCD26403534
Product Description
Catalog Number:
AG00A1I7
Chemical Name:
6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine
CAS Number:
1314137-24-0
Molecular Formula:
C12H16BN3O2
Molecular Weight:
245.0853
MDL Number:
MFCD26403534
IUPAC Name:
6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine
InChI:
InChI=1S/C12H16BN3O2/c1-11(2)12(3,4)18-13(17-11)9-5-6-10-15-14-8-16(10)7-9/h5-8H,1-4H3
InChI Key:
IVGGHSWKRUSCTF-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc2n(c1)cnn2
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.134g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.089g/mol
Monoisotopic Mass:
245.134g/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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