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ChemicalBook--->CAS DataBase List--->76-50-6

76-50-6

76-50-6 Structure

76-50-6 Structure
IdentificationBack Directory
[Name]

Bornyl isovalerate
[CAS]

76-50-6
[Synonyms]

Hysterol
Bornyval
Ai3-04348
FEMA 2165
BORNYL ISOVALERATE
BORNEOL ISOVALERATE
BORNYL ISOPENTANOATE
2-Bornyl isovalerate
endo-Bornylisovalerat
(-)-bornyl isovalerate
endo-bornyl isovalerate
iso-valerianatedebornyle
Bornyl 3-methylbutanoate
2-Bornyl 3-methylbutyrate
BORNYL ISOVALERATE (ENDO-)
Isobornyl 3-methylbutanoate
(-)-BORNYL ISOVALERATE 97+%
Bornyl isovalerate USP/EP/BP
ISOVALERIC ACID 2-BORNYL ESTER
Bornyl ester of isopentanoic acid
endo-1,7,7-trimethylbicyclo(2.2.1)hept-2-yl3-methylbutanoate
endo-3-methylbutanoicacid1,7,7-trimethylbicyclo(2.2.1)hept-2-ylester
3-methyl-,1,7,7-trimethylbicyclo(2.2.1)hept-2-ylester,endo-butanoicaci
3-methyl-,1,7,7-trimethylbicyclo[2.2.1]hept-2-ylester,endo-butanoicaci
3-methyl-,1,7,7-trimethylbicyclo[2.2.1]hept-2-ylester,endo-Butanoicacid
[(1S,4R,6R)-1,7,7-Trimethyl-6-bicyclo[2.2.1]heptanyl] 3-methylbutanoate
Butanoic acid, 3-methyl-, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, endo-
3-methylbutanoic acid [(3R,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] ester
Butanoic acid, 3-methyl-, (1R,2S,4R)-1,7,7-trimethylbicyclo2.2.1hept-2-yl ester, rel-
bornylisovalerate,1,7,7-trimethylbicyclo[2.2.1]heptan-2-olisopentanoate,borneolisopentanoate,bornyval
[EINECS(EC#)]

200-966-5
[Molecular Formula]

C15H26O2
[MDL Number]

MFCD00053464
[MOL File]

76-50-6.mol
[Molecular Weight]

238.37
Chemical PropertiesBack Directory
[alpha ]

-32.5 º (neat)
[Boiling point ]

255-260 °C(lit.)
[density ]

0.949 g/mL at 25 °C(lit.)
[FEMA ]

2165 | BORNYL ISOVALERATE (ENDO-)
[refractive index ]

n20/D 1.46(lit.)
[Fp ]

>230 °F
[color ]

Colourless liquid with an odour and taste of valerian and camphor.
[Odor]

at 100.00 %. valerian camphor tropical
[Odor Type]

herbal
[JECFA Number]

1393
[LogP]

5.01
[NIST Chemistry Reference]

Butanoic acid, 3-methyl-, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, endo-(76-50-6)
[EPA Substance Registry System]

2-Bornyl isovalerate (76-50-6)
Safety DataBack Directory
[WGK Germany ]

2
[RTECS ]

EK7902550
[Toxicity]

Both the acute oral LD50 value in rats and the acute dermal LD50 value in rabbits exceeded 5 g/kg.
Hazard InformationBack Directory
[Description]

Bornyl isovalerate is a colorless liquid. Insoluble in water.Sp.Gr. 0.955. B.P.260℃.
[Chemical Properties]

Bornyl isovalerate has a warm, herbaceous, slightly earthy-green aroma.
[Occurrence]

l-Bornyl isovalerate has been reported in valerian and angelica root oil; d-bornyl isovalerate is not reported found in nature.
[Uses]

Bornyl isovalerate is used in certain fruit flavor compositions, concentrations are but a few ppm (traces) in the finished product.
[Preparation]

d-Bornyl isovalerate can be prepared by heating to 140°C d-borneol and isovaleric acid.
[Solubility in organics]

Almost insoluble in Propylene glycol and Glycerin, soluble in alcohol and oils.
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