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Home > Boronic Acids > 2096331-11-0
2096331-11-0 | 4-Acetyl-2-methylphenylboronic acid
CAS No: 2096331-11-0 Catalog No: AG01EHNT MDL No:MFCD19237178
Product Description
Catalog Number:
AG01EHNT
Chemical Name:
4-Acetyl-2-methylphenylboronic acid
CAS Number:
2096331-11-0
MDL Number:
MFCD19237178
IUPAC Name:
(4-acetyl-2-methylphenyl)boronic acid
InChI:
InChI=1S/C9H11BO3/c1-6-5-8(7(2)11)3-4-9(6)10(12)13/h3-5,12-13H,1-2H3
InChI Key:
UMMXHEAOPLVLKG-UHFFFAOYSA-N
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.08g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
177.994g/mol
Monoisotopic Mass:
178.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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