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Home > Boronic Acids > 1073355-14-2
1073355-14-2 | 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl);benzo[c][1,2,5]oxadiazole
CAS No: 1073355-14-2 Catalog No: AG007WBG MDL No:MFCD09842717
Product Description
Catalog Number:
AG007WBG
Chemical Name:
5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl);benzo[c][1,2,5]oxadiazole
CAS Number:
1073355-14-2
Molecular Formula:
C12H15BN2O3
Molecular Weight:
246.0701
MDL Number:
MFCD09842717
IUPAC Name:
5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,1,3-benzoxadiazole
InChI:
InChI=1S/C12H15BN2O3/c1-11(2)12(3,4)17-13(16-11)8-5-6-9-10(7-8)15-18-14-9/h5-7H,1-4H3
InChI Key:
MQXANAGMQAYTMV-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc2c(c1)non2
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.118g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.073g/mol
Monoisotopic Mass:
246.118g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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