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Home > Boronic Acids > 1362243-56-8
1362243-56-8 | 1-Methyl-6-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-1H-benzo[d][1,2,3]triazole
CAS No: 1362243-56-8 Catalog No: AG009Y1S MDL No:MFCD22628498
Product Description
Catalog Number:
AG009Y1S
Chemical Name:
1-Methyl-6-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-1H-benzo[d][1,2,3]triazole
CAS Number:
1362243-56-8
Molecular Formula:
C13H18BN3O2
Molecular Weight:
259.1119
MDL Number:
MFCD22628498
IUPAC Name:
1-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzotriazole
InChI:
InChI=1S/C13H18BN3O2/c1-12(2)13(3,4)19-14(18-12)9-6-7-10-11(8-9)17(5)16-15-10/h6-8H,1-5H3
InChI Key:
QLCHUVQJHLKHJN-UHFFFAOYSA-N
SMILES:
Cn1nnc2c1cc(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:
49.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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