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1150271-59-2

1150271-59-2 | Ethanone, 1-[7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzodioxol-5-yl]-

CAS No: 1150271-59-2 Catalog No: AG000FPP MDL No:MFCD11855978

Product Description

Catalog Number:
AG000FPP
Chemical Name:
Ethanone, 1-[7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzodioxol-5-yl]-
CAS Number:
1150271-59-2
Molecular Formula:
C15H19BO5
Molecular Weight:
290.1194
MDL Number:
MFCD11855978
IUPAC Name:
1-[7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzodioxol-5-yl]ethanone
InChI:
InChI=1S/C15H19BO5/c1-9(17)10-6-11(13-12(7-10)18-8-19-13)16-20-14(2,3)15(4,5)21-16/h6-7H,8H2,1-5H3
InChI Key:
AZCKRWLNQMTQCO-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc(B2OC(C(O2)(C)C)(C)C)c2c(c1)OCO2

Properties

Complexity:
420  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.133g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.122g/mol
Monoisotopic Mass:
290.133g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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