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Heptanophenone

CAS No.:
1671-75-6
Catalog Number:
AG001X4Q
Molecular Formula:
C13H18O
Molecular Weight:
190.2814
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
>98.0%(GC)
1 week
United States
$124
- +
500g
>98.0%(GC)
1 week
United States
$746
- +
Product Description
Catalog Number:
AG001X4Q
Chemical Name:
Heptanophenone
CAS Number:
1671-75-6
Molecular Formula:
C13H18O
Molecular Weight:
190.2814
MDL Number:
MFCD00009539
IUPAC Name:
1-phenylheptan-1-one
InChI:
InChI=1S/C13H18O/c1-2-3-4-8-11-13(14)12-9-6-5-7-10-12/h5-7,9-10H,2-4,8,11H2,1H3
InChI Key:
UXMQORVHJMUQFD-UHFFFAOYSA-N
SMILES:
CCCCCCC(=O)c1ccccc1
EC Number:
216-802-0
UNII:
KX07WP06JY
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.136g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.286g/mol
Monoisotopic Mass:
190.136g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Literature
Title Journal
Kinetic performance comparison of a capillary monolithic and a fused-core column in micro-scale liquid chromatography. Journal of chromatography. A 20121026
An extraction technique for analytical sample preparation in aqueous solution based on controlling dispersion of ionic surfactant assemblies in isotachophoretic migration. Journal of chromatography. A 20110107
Inhibition of carbonyl reductase activity in pig heart by alkyl phenyl ketones. Journal of enzyme inhibition and medicinal chemistry 20070201
Effect of surfactant counterion and organic modifier on the properties of surfactant vesicles in electrokinetic chromatography. Journal of separation science 20050801
Properties