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L2807

Sigma-Aldrich

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
Beilstein:
1724500
EC Number:
204-116-4
MDL number:
MFCD00008907
UNSPSC Code:
12352100
PubChem Substance ID:
24896327
NACRES:
NA.22

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.)

SMILES string

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

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

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Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H317,H319

Hazard Classifications

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

Storage Class Code

10 - Combustible liquids

WGK

WGK 1

Flash Point(F)

201.2 °F - closed cup

Flash Point(C)

94 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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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
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
Antonella Di Sotto et al.
Environmental and molecular mutagenesis, 52(1), 69-71 (2010-09-15)
The potential genotoxicity of lavender essential oil and its major components, linalool, and linalyl acetate, was evaluated in vitro by the micronucleus test on peripheral human lymphocytes. In the range of non-toxic concentrations (0.5-100 μg/ml), linalyl acetate increased the frequency
Krzysztof Cal et al.
Journal of controlled release : official journal of the Controlled Release Society, 93(3), 369-376 (2003-12-04)
The purpose of the study was to investigete skin absorption and elimination of three acyclic terpenes: citronellol (C), linalool (L) and linalyl acetate (LA). The pure terpenes were applied onto the human skin in vitro, and after 1-4 h, their
Marina Soković et al.
Molecules (Basel, Switzerland), 15(11), 7532-7546 (2010-10-30)
The chemical composition and antibacterial activity of essential oils from 10 commonly consumed herbs: Citrus aurantium, C. limon, Lavandula angustifolia, Matricaria chamomilla, Mentha piperita, M. spicata, Ocimum basilicum, Origanum vulgare, Thymus vulgaris and Salvia officinalis have been determined. The antibacterial
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