Home Other Building Blocks 4-ISOBUTYRYLACETOPHENONE

4-ISOBUTYRYLACETOPHENONE

CAS No.:
103931-20-0
Catalog Number:
AG008T1M
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG008T1M
Chemical Name:
4-ISOBUTYRYLACETOPHENONE
CAS Number:
103931-20-0
MDL Number:
MFCD08275600
IUPAC Name:
1-(4-acetylphenyl)-2-methylpropan-1-one
InChI:
InChI=1S/C12H14O2/c1-8(2)12(14)11-6-4-10(5-7-11)9(3)13/h4-8H,1-3H3
InChI Key:
OKDVJTURSCLUBA-UHFFFAOYSA-N
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.099g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.242g/mol
Monoisotopic Mass:
190.099g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Mechanochemistry of ibuprofen pharmaceutical. Chemosphere 20120701
Properties