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ethyl linalyl acetate

Chemical Structure

General Material Information

Preferred name ethyl linalyl acetate
Trivial Name 1,6-Nonadien-3-ol, 3,7-dimethyl-, 3-acetate
Short Description 1,6-nonadien-3-ol, 3,7-dimethyl-, acetate
Formula C13 H22 O2
CAS Number 61931-80-4
ECHA Number 263-336-9
FDA UNII Search
Nikkaji Number J59.351F
Beilstein Number 1779089
NMR Predictor External link
Synonyms
  • 1,5-dimethyl-1-vinyl hept-4-enyl acetate
  • 1,5-dimethyl-1-vinylhept-4-enyl acetate
  • 3,7-dimethyl-1,6-nonadien-3-yl acetate
  • 3,7-dimethyl-1,6-nonadiene-3-yl acetate
  • [(6E)-3,7-dimethylnona-1,6-dien-3-yl] acetate
  • ethyllinalyl acetate
  • homo linalyl acetate
  • 1,6-nonadien-3-ol, 3,7-dimethyl-, acetate
  • [(6E)-3,7-dimethylnona-1,6-dien-3-yl] acetate
  • 1,6-Nonadien-3-ol, 3,7-dimethyl-, 3-acetate
  • 1,6-Nonadien-3-ol, 3,7-dimethyl-, acetate

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Other Information

(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2915.39.9050
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 210.31674194336
Boiling Point 246 to 247°C @ 760 mm Hg
Vapor Pressure 0.026 mmHg @ 25 °C
Flash Point TCC Value 82.78 °C TCC
logP (o/w) 4.416 est
Solubility
alcohol Yes
water, 20 mg/L @ 20 °C (exp) Yes
Stability
alcoholic - good Unspecified
antiperspirant spray - moderate Unspecified
APC (pH = 10) - good Unspecified
candles - good Unspecified
damp fabric - moderate Unspecified
dry fabric - poor Unspecified
liquid bleach - poor Unspecified
pH = 2 - moderate Unspecified
powder detergent - good Unspecified
powder detergent + activator - moderate Unspecified
soap - good Unspecified
toiletries - good Unspecified

Organoleptic Properties

Odor Type: Floral
floral, bergamot, fruity, tropical, rose
Odor strength medium
Substantivity 16 hour(s) at 100.00 %
Luebke, William tgsc, (1985) At 100.00 %. floral bergamot fruity tropical rose
Ethyl Linalyl Acetate is softer, more floral, more bergamot and less lavender than Linalyl Acetate. It has an elegant, refreshing effect in floral bouquets. Fresh, Bergamot, Fruity, Pear like
General comment Fresh, floral, citrusy connotations, bergamot- and lavender notes

Safety Information

Safety information

European information :
Most important hazard(s):
Xi - Irritant
R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
Flammable liquids (Category 4), H227
Skin irritation (Category 2), H315
Eye irritation (Category 2A), H319
Serious eye damage/eye irritation (Category 2A), H320
Chronic aquatic toxicity (Category 2), H411
GHS Label elements, including precautionary statements
Pictogramexclamation-mark.jpgenvironment.jpg
Signal word Warning
Hazard statement(s)
H227 - Combustible liquid
H315 - Causes skin irritation
H319 - Causes serious eye irritation
H320 - Causes eye irritation
H411 - Toxic to aquatic life with long lasting effects
Precautionary statement(s)
P210 - Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P264 - Wash skin thouroughly after handling.
P273 - Avoid release to the environment.
P280 - Wear protective gloves/protective clothing/eye protection/face protection.
P302 + P352 - IF ON SKIN: wash with plenty of soap and water.
P305 + P351 + P338 - IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
P332 + P313 - IF SKIN irritation occurs: Get medical advice/attention.
P337 + P313 - IF eye irritation persists: Get medical advice/attention.
P362 - Take off contaminated clothing and wash before reuse.
P370 + P378 - In case of fire: Use dry sand, dry chemical or alcohol-resistant foam for extinction.
P391 - Collect spillage. Hazardous to the aquatic environment
P403 + P235 - Store in a well-ventilated place. Keep cool.
P501 - Dispose of contents/ container to an approved waste disposal plant.
Oral/Parenteral Toxicity:
oral-rat LD50 > 5000 mg/kg
Food and Chemical Toxicology. Vol. 20, Pg. 681, 1982.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Chemical Toxicology. Vol. 20, Pg. 681, 1982.

Inhalation Toxicity:
Not determined

Safety in use information

Category:
fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for ethyl linalyl acetate usage levels up to:
40.0000 % in the fragrance concentrate.
Recommendation for ethyl linalyl acetate flavor usage levels up to:
not for flavor use.

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):61931-80-4
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :6434672
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
[(6E)-3,7-dimethylnona-1,6-dien-3-yl] acetate
Chemidplus:0061931804