Basic information Safety Supplier Related

CITRONELLYL ISOBUTYRATE

Basic information Safety Supplier Related

CITRONELLYL ISOBUTYRATE Basic information

Product Name:
CITRONELLYL ISOBUTYRATE
Synonyms:
  • CITRONELLYL ISOBUTYRATE
  • CITRONELLYL 2-METHYLPROPIONATE
  • FEMA 2313
  • 3,7-DIMETHYL-6-OCTEN-1-YL-2-METHYL PROPANOATE
  • 3,7-DIMETHYL-6-OCTEN-1-YL ISOBUTYRATE
  • 6-OCTEN-1-OL, 3,7-DIMETHYL:ISOBUTYRATE
  • RHODINYL ISOBUTYRATE
  • 3,7-dimethyloct-7-enyl isobutyrate
CAS:
138-23-8
MF:
C14H26O2
MW:
226.35
EINECS:
205-318-5
Mol File:
138-23-8.mol
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CITRONELLYL ISOBUTYRATE Chemical Properties

Boiling point:
253 °C(lit.)
Density 
0.875 g/mL at 25 °C(lit.)
FEMA 
2983 | RHODINYL ISOBUTYRATE
refractive index 
n20/D 1.442(lit.)
Flash point:
>230 °F
color 
A colourless oily liquid. Consists of a mixture of the isobutyrates of 1-citronellol and geraniol, principally 3,7-dimethyl-6-octen-l-yl isobutyrate.
Odor
at 100.00 %. sweet natural red rose spicy fruity tropical geranium
Odor Type
floral
JECFA Number
74
LogP
5.17
EPA Substance Registry System
Propanoic acid, 2-methyl-, 3,7-dimethyl-7-octenyl ester (138-23-8)
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Safety Information

WGK Germany 
2
Toxicity
Both the acute oral LD50 value in rats and the acute dermal LD50 value in rabbits exceeded 5 g/kg (Moreno, 1975).

MSDS

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CITRONELLYL ISOBUTYRATE Usage And Synthesis

Chemical Properties

Rhodinyl isobutyrate has a fruity, sweet, floral odor with a fruity, floral, pineapple-like flavor, intensely sweet.

Occurrence

Has apparently not been reported to occur in nature.

Definition

ChEBI: Rhodinyl isobutyrate is a carboxylic ester.

Preparation

From rhodinol and isobutyric anhydride.

Metabolism

Open-chain olefinic terpene esters are presumably hydrolysed to the alcohol and the acid (Fassett, 1963). In the rabbit, the open-chain terpenes undergo ω-oxidation (Williams, 1959).

CITRONELLYL ISOBUTYRATESupplier

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