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3-(hydroxymethyl)heptan-2-one

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3-(hydroxymethyl)heptan-2-one Basic information

Product Name:
3-(hydroxymethyl)heptan-2-one
Synonyms:
  • 3-(hydroxymethyl)heptan-2-one
  • 2-Heptanone, 3-(hydroxymethyl)-
  • OCTAN-3-ONE-1-OL
  • 3-OCTANON-1-OL
  • 3-(HYDROXYMETHYL)-2-HEPTANONE
  • 3-(hydroxymethyl)heptan-2-one USP/EP/BP
CAS:
65405-68-7
MF:
C8H16O2
MW:
144.21
EINECS:
265-739-5
Product Categories:
  • ketone Flavor
Mol File:
65405-68-7.mol
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3-(hydroxymethyl)heptan-2-one Chemical Properties

Boiling point:
112-113 °C(Press: 11 Torr)
Density 
0.9374 g/cm3
FEMA 
2804 | 3-(HYDROXYMETHYL)-2-HEPTANONE
storage temp. 
2-8°C
pka
14.44±0.10(Predicted)
Odor
at 1.00 % in dipropylene glycol. fruity herbal spicy
Odor Type
herbal
JECFA Number
604
LogP
1.16
EPA Substance Registry System
2-Heptanone, 3-(hydroxymethyl)- (65405-68-7)
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3-(hydroxymethyl)heptan-2-one Usage And Synthesis

Chemical Properties

3-Octanon-1-ol has a powerful, fruity, herbaceous, spicy odor. The odor is slightly bitter above 20 ppm; otherwise, warm and fruity.

Preparation

By partial hydrogenation of the corresponding di-ketone at 100°C over Raney-Ni in methanol solution; also by condensation of methyl amyl ketone with formaldehyde under mildly alkaline conditions.

Definition

ChEBI: 3-(Hydroxymethyl)-2-heptanone is an aliphatic alcohol.

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