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Merck
CN

L2807

3,7-Dimethyl-1,6-octadien-3-yl acetate

97%

Synonym(s):

Linalyl acetate, 3,7-Dimethyl-1,6-octadien-3-yl acetate, Bergamol

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About This Item

Linear Formula:
CH3CO2C(CH=CH2)(CH3)CH2CH2CH=C(CH3)2
CAS Number:
115-95-7
Molecular Weight:
196.29
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24896327
EC Number:
204-116-4
Beilstein/REAXYS Number:
1724500
MDL number:
MFCD00008907
Assay:
97%

Key Documents

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Product Name

3,7-Dimethyl-1,6-octadien-3-yl acetate, 97%

InChI

1S/C12H20O2/c1-6-12(5,14-11(4)13)9-7-8-10(2)3/h6,8H,1,7,9H2,2-5H3

InChI key

UWKAYLJWKGQEPM-UHFFFAOYSA-N

SMILES string

C\C(C)=C\CCC(C)(OC(C)=O)C=C

vapor density

6.8 (vs air)

vapor pressure

0.1 mmHg ( 20 °C)

assay

97%

refractive index

n20/D 1.453 (lit.)

bp

220 °C (lit.)

density

0.901 g/mL at 25 °C (lit.)

Quality Level

100

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GHS07

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Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - Skin Sens. 1B

Storage Class

10 - Combustible liquids

wgk

WGK 1

flash_point_f

201.2 °F - closed cup

flash_point_c

94 °C - closed cup

ppe

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter

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Certificates of Analysis (COA)

Lot/Batch Number
SDBB5475
STBK8379
STBK5129
STBD2811V
STBF4770V

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Maria Sköld et al.
Contact dermatitis, 58(1), 9-14 (2007-12-25)
Fragrances are among the most common causes of allergic contact dermatitis. We have in previous studies shown that linalool, present in lavender oil, autoxidizes on air exposure, forming allergenic oxidation products. Oxidized linalool was found to be a frequent cause
Domenico Trombetta et al.
Antimicrobial agents and chemotherapy, 49(6), 2474-2478 (2005-05-27)
In the present paper, we report the antimicrobial efficacy of three monoterpenes [linalyl acetate, (+)menthol, and thymol] against the gram-positive bacterium Staphylococcus aureus and the gram-negative bacterium Escherichia coli. For a better understanding of their mechanisms of action, the capability
Wafica S Itani et al.
Cancer biology & therapy, 7(11), 1765-1773 (2008-09-13)
Lebanese sage essential oil possesses antitumor properties, however, the bioactive components and antitumor mechanisms are not known. Here we show that combining the three sage bioactive compounds, Linalyl acetate (Ly), Terpeniol (Te) and Camphor (Ca), caused synergistic inhibition of the
E Barocelli et al.
Life sciences, 76(2), 213-223 (2004-11-03)
In this study the antinociceptive and the gastroprotective effects of orally administered or inhaled Lavandula hybrida Reverchon "Grosso" essential oil, and its principal constituents linalool and linalyl acetate were evaluated in rodents. Either when orally administered (100 mg/kg) or inhaled
Ali Reza Fakhari et al.
Journal of chromatography. A, 1098(1-2), 14-18 (2005-11-30)
A new method involving concurrent headspace solvent microextraction combined with continuous hydrodistillation (HD-HSME) for the extraction and pre-concentration of the essential oil of Lavandula angustifolia Mill. into a microdrop is developed. A microdrop of n-hexadecane containing n-heptadecane (as internal standard)
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