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Home > Boronic Acids > 1186334-82-6
1186334-82-6 | 4-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-1,3-dihydro-benzoimidazol-2-one
CAS No: 1186334-82-6 Catalog No: AG0096ZS MDL No:MFCD22572128
Product Description
Catalog Number:
AG0096ZS
Chemical Name:
4-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-1,3-dihydro-benzoimidazol-2-one
CAS Number:
1186334-82-6
Molecular Formula:
C13H17BN2O3
Molecular Weight:
260.0967
MDL Number:
MFCD22572128
IUPAC Name:
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-dihydrobenzimidazol-2-one
InChI:
InChI=1S/C13H17BN2O3/c1-12(2)13(3,4)19-14(18-12)8-6-5-7-9-10(8)16-11(17)15-9/h5-7H,1-4H3,(H2,15,16,17)
InChI Key:
NMFRSSLLXHMHCL-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cccc2c1[nH]c(=O)[nH]2
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.133g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
260.1g/mol
Monoisotopic Mass:
260.133g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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