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Home > Boronic Acids > 1313399-38-0
1313399-38-0 | 2-Methyl-6-(4,4,5,5-tetraMethyl-[1,3,2]dioxaborolan-2-yl)-2,3-dihydro-isoindol-1-one
CAS No: 1313399-38-0 Catalog No: AG009WHE MDL No:MFCD12755781
Product Description
Catalog Number:
AG009WHE
Chemical Name:
2-Methyl-6-(4,4,5,5-tetraMethyl-[1,3,2]dioxaborolan-2-yl)-2,3-dihydro-isoindol-1-one
CAS Number:
1313399-38-0
Molecular Formula:
C15H20BNO3
Molecular Weight:
273.1352
MDL Number:
MFCD12755781
IUPAC Name:
2-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3H-isoindol-1-one
InChI:
InChI=1S/C15H20BNO3/c1-14(2)15(3,4)20-16(19-14)11-7-6-10-9-17(5)13(18)12(10)8-11/h6-8H,9H2,1-5H3
InChI Key:
VBWYOZWWAKZWKG-UHFFFAOYSA-N
SMILES:
CN1Cc2c(C1=O)cc(cc2)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
407
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.154g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.139g/mol
Monoisotopic Mass:
273.154g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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