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ChemicalBook--->CAS DataBase List--->126-64-7

126-64-7

126-64-7 Structure

126-64-7 Structure
IdentificationBack Directory
[Name]

LINALYL BENZOATE
[CAS]

126-64-7
[Synonyms]

FEMA 2638
FEMA 2635
Linalylbenzoat
LINALYL BENZOATE
Linallyl benzoate
benzoicacid,linalylester
Linalyl benzoate USP/EP/BP
6-octadien-3-ol,3,7-dimethyl-benzoate
3,7-dimethyl-1,6-octadien-3-ylbenzoate
3,7-diMethylocta-1,6-dien-3-yl benzoate
1,6-Octadien-3-ol,3,7-dimethyl-,benzoate
1,5-dimethyl-1-vinyl-4-hexen-1-obenzoate
1,5-dimethyl-1-vinyl-4-hexen-1-ylbenzoate
1,6-Octadien-3-ol, 3,7-dimethyl-, 3-benzoate
Benzoic acid 1,5-dimethyl-1-vinyl-4-hexenyl ester
Benzoic acid 3,7-dimethyl-1,6-octadien-3-yl ester
1,6-OCTADIEN-3-OL, 3,7-DIMETHYL-, BENZOATE,94%, GLC
[EINECS(EC#)]

204-796-2
[Molecular Formula]

C17H22O2
[MDL Number]

MFCD00048302
[MOL File]

126-64-7.mol
[Molecular Weight]

258.36
Chemical PropertiesBack Directory
[Boiling point ]

213 °C(lit.)
[density ]

0.98 g/mL at 25 °C(lit.)
[FEMA ]

2638 | LINALYL BENZOATE
[refractive index ]

n20/D 1.508(lit.)
[Fp ]

>230 °F
[Odor]

at 100.00 %. floral bergamot genet herbal tuberose tropical lily plum ylang grape
[Odor Type]

floral
[JECFA Number]

859
[LogP]

6.14
[CAS DataBase Reference]

126-64-7
[EPA Substance Registry System]

1,6-Octadien-3-ol, 3,7-dimethyl-, benzoate (126-64-7)
Safety DataBack Directory
[WGK Germany ]

2
[RTECS ]

DH3300000
[Toxicity]

Both the acute oral LD50 value in rats and the acute dermal LD50 value in rabbits exceeded 5 g/kg(Moreno, 1973).
Hazard InformationBack Directory
[Description]

Linalyl benzoate has a heavy odor reminiscent of genet, bergamc and lily. It may be prepared from linalool and benzoyl chloride the presence of pyridine.
[Chemical Properties]

Linalyl benzoate has a heavy odor reminiscent of floral, balsamic and fruity.
[Occurrence]

Reported found in the essential oils of ylang-ylang and tuberose; also in mushrooms.
[Definition]

ChEBI: Linalyl benzoate is a monoterpenoid.
[Preparation]

From linalool and benzoyl chloride in the presence of tuberose.
Questions And AnswerBack Directory
[Aroma]

Balsamic-floral, Bergamot-fruity odor of good tenacity. The odor varies considerably according to the method of production of this ester. Above description is based upon the "Roche"-processed material, while older methods yield esters of far greater sweetness, less tenacity and more similarity to Linalyl acetate, often with side-notes of Methylbenzoate. Peculiar, deep-sweet, fruity or fruit-preservelike odor, mainly of Plum-type.
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