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Home > Boronic Acids > 2096332-77-1
2096332-77-1 | 4-Butanoylphenylboronic acid, pinacol ester
CAS No: 2096332-77-1 Catalog No: AG01EHMK MDL No:MFCD21332948
Product Description
Catalog Number:
AG01EHMK
Chemical Name:
4-Butanoylphenylboronic acid, pinacol ester
CAS Number:
2096332-77-1
MDL Number:
MFCD21332948
IUPAC Name:
1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]butan-1-one
InChI:
InChI=1S/C16H23BO3/c1-6-7-14(18)12-8-10-13(11-9-12)17-19-15(2,3)16(4,5)20-17/h8-11H,6-7H2,1-5H3
InChI Key:
KXACZLKHSCCLGY-UHFFFAOYSA-N
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.174g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.167g/mol
Monoisotopic Mass:
274.174g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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