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Home > Boronic Acids > 1119090-20-8
1119090-20-8 | 2-Methyl-5-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,4-oxadiazole
CAS No: 1119090-20-8 Catalog No: AG00HC71 MDL No:MFCD18384930
Product Description
Catalog Number:
AG00HC71
Chemical Name:
2-Methyl-5-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,4-oxadiazole
CAS Number:
1119090-20-8
Molecular Formula:
C15H19BN2O3
Molecular Weight:
286.1340
MDL Number:
MFCD18384930
IUPAC Name:
2-methyl-5-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,4-oxadiazole
InChI:
InChI=1S/C15H19BN2O3/c1-10-17-18-13(19-10)11-7-6-8-12(9-11)16-20-14(2,3)15(4,5)21-16/h6-9H,1-5H3
InChI Key:
VAYBFKYRSDONPS-UHFFFAOYSA-N
SMILES:
Cc1nnc(o1)c1cccc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.149g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.138g/mol
Monoisotopic Mass:
286.149g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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