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Hexanophenone

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Hexanophenone Basic information

Product Name:
Hexanophenone
Synonyms:
  • Amyl Phenyl Ketone Caprophenone
  • N-PENTYL PHENYL KETONE
  • N-HEXANOPHENONE
  • N-AMYL PHENYL KETONE
  • PENTYL PHENYL KETONE
  • 1-phenyl-1-hexanon
  • 1-Phenyl-1-hexanone
  • Hexaphenone
CAS:
942-92-7
MF:
C12H16O
MW:
176.25
EINECS:
213-394-6
Product Categories:
  • C11 to C12
  • Carbonyl Compounds
  • Building Blocks
  • Chemical Synthesis
  • Ketones
  • Organic Building Blocks
  • 942-92-7
Mol File:
942-92-7.mol
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Hexanophenone Chemical Properties

Melting point:
25-26 °C (lit.)
Boiling point:
265 °C (lit.)
Density 
0.958 g/mL at 25 °C (lit.)
refractive index 
n20/D 1.5105(lit.)
Flash point:
>230 °F
storage temp. 
Inert atmosphere,Room Temperature
form 
Liquid After Melting
color 
Clear light yellow
BRN 
1908667
InChI
InChI=1S/C12H16O/c1-2-3-5-10-12(13)11-8-6-4-7-9-11/h4,6-9H,2-3,5,10H2,1H3
InChIKey
MAHPVQDVMLWUAG-UHFFFAOYSA-N
SMILES
C(C1=CC=CC=C1)(=O)CCCCC
LogP
3.790 (est)
CAS DataBase Reference
942-92-7(CAS DataBase Reference)
EPA Substance Registry System
Hexanophenone (942-92-7)
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Safety Information

Hazard Codes 
Xi
Risk Statements 
36/37/38
Safety Statements 
26-37/39
WGK Germany 
3
TSCA 
Yes
HS Code 
29143900

MSDS

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Hexanophenone Usage And Synthesis

Chemical Properties

clear light yellow liquid after melting

Uses

Caprophenone is an inhibitor of carbonyl reductase activity in pig’s heart cytosol. A useful research chemical.

Synthesis Reference(s)

The Journal of Organic Chemistry, 44, p. 3585, 1979 DOI: 10.1021/jo01334a033
Synthetic Communications, 8, p. 59, 1978 DOI: 10.1080/00397917808062184
Tetrahedron Letters, 24, p. 3677, 1983 DOI: 10.1016/S0040-4039(00)88199-X

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