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nerolidyl acetate

Chemical Structure

General Material Information

Preferred name nerolidyl acetate
Trivial Name Nerolidol acetate
Short Description 1,6,10-dodecatrien-3-ol, 3,7,11-trimethyl-, acetate
Formula C17 H28 O2
CAS Number 2306-78-7
ECHA Number 218-978-4
FDA UNII Search
Nikkaji Number J213.179J
xLogP3-AA 5.20 (est)
NMR Predictor External link
Synonyms
  • 1,6,10-dodecatrien-3-ol, 3,7,11-trimethyl-, acetate
  • nerolidol acetate
  • 3,7,11-trimethyl dodeca-1,6,10-trien-3-yl acetate
  • trimethyl dodecatrien-3-yl acetate
  • 3,7,11-trimethyl-1,6,10-dodecatrien-3-yl acetate
  • 3,7,11-trimethyldodeca-1,6,10-trien-3-yl acetate
  • [(6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl] acetate
  • [(6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl] acetate
  • 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-acetate
  • 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, acetate
  • 3,7,11-Trimethyl-1,6,10-dodecatrien-3-yl acetate
  • NSC 72036

US / EU / FDA / JECFA / FEMA / Scholar / Patents

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Literature & References

[(6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl] acetate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:2306-78-7
Pubchem (cid):5363426
Pubchem (sid):135057319
Publications by PubMed
Chemical composition of essential oils from four Vietnamese species of piper (piperaceae).
A new source of elemol rich essential oil and existence of multicellular oil glands in leaves of the Dioscorea species.
Chemical composition and in vitro antimicrobial and antioxidant activities of Citrus aurantium l. flowers essential oil (Neroli oil).
Characterization of essential oil from Citrus aurantium L. flowers: antimicrobial and antioxidant activities.
Steps in the biosynthesis of fuscumol in the longhorn beetles Tetropium fuscum (F.) and Tetropium cinnamopterum Kirby.
Antibacterial/antifungal activity and synergistic interactions between polyprenols and other lipids isolated from Ginkgo biloba L. leaves.
Volatile oil constituents of different parts of Artemisia chamaemelifolia and the composition and antibacterial activity of the aerial parts of A. turcomanica from Iran.
Analysis of the essential oil of large cardamom (Amomum subulatum Roxb.) growing in different agro-climatic zones of Himachal Pradesh, India.
Volatiles from apple trees infested with light brown apple moth larvae attract the parasitoid Dolichogenidia tasmanica.
Chemical composition and antioxidant and anticandidal activities of essential oils from different wild Moroccan Thymus species.
Chemical diversity of essential oils from Asteriscus graveolens (Forssk.) less.: identification of cis-8-Acetoxychrysanthenyl acetate as a new natural component.
Composition of seed essential oils of Rhododendron tomentosum.
Essential oil composition of three Australian endemic species of Darwinia (Myrtaceae).
Volatile emissions from Alnus glutionosa induced by herbivory are quantitatively related to the extent of damage.
Pharmacological interactions of essential oil constituents on the viability of micro-organisms.
Volatile constituents of two rare subspecies of Thymus praecox.
Hydrophobic constituents and their potential anticancer activities from Devil's Club (Oplopanax horridus Miq.).
Quantitative analysis of six polyynes and one polyene in Oplopanax horridus and Oplopanax elatus by pressurized liquid extraction and on-line SPE-HPLC.
Essential-oil composition, antileishmanial, and toxicity study of Artemisia abyssinica and Satureja punctata ssp. punctata from Ethiopia.
The tea weevil, Myllocerinus aurolineatus, is attracted to volatiles induced by conspecifics.
Attraction of New Zealand flower thrips, Thrips obscuratus, to cis-jasmone, a volatile identified from Japanese honeysuckle flowers.
Quantification approach for assessment of sparkling wine volatiles from different soils, ripening stages, and varieties by stir bar sorptive extraction with liquid desorption.
Phenology of semiochemical-mediated host foraging by the western boxelder bug, Boisea rubrolineata, an aposematic seed predator.
Essential Oil Composition and Antibacterial Studies of Vitex negundo Linn. Extracts.
The influence of different nutrient levels on insect-induced plant volatiles in Bt and conventional oilseed rape plants.
Essential oil composition of the different parts of Eryngium corniculatum Lam. (Apiaceae) from Spain.
Anti-inflammation activities of essential oil and its constituents from indigenous cinnamon (Cinnamomum osmophloeum) twigs.
Expression of plant flavor genes in Lactococcus lactis.
Bioavailability of nerodilol-based transdermal therapeutic system of nicorandil in human volunteers.
Screening for key odorants in Moroccan green olives by gas chromatography-olfactometry/aroma extract dilution analysis.
Volatile organic compounds as signals in a plant-herbivore system: electrophysiological responses in olfactory sensilla of the moth Cactoblastis cactorum.
Gain and loss of fruit flavor compounds produced by wild and cultivated strawberry species.
Determination of key odorant compounds in freshly distilled cognac using GC-O, GC-MS, and sensory evaluation.
Electroantennographic and behavioral responses of the sphinx moth Manduca sexta to host plant headspace volatiles.
[Study on the chemical constituents of the volatile oil from Lysimachia trientaloides Hemsl].
Characterization of the odor-active volatiles in citrus Hyuganatsu (Citrus tamurana Hort. ex Tanaka).
Chemical and biological studies on two Helichrysum species of Greek origin.
Isolation and identification of allelochemicals that attract the larval parasitoid,Cotesia marginiventris (Cresson), to the microhabitat of one of its hosts.
Cell-cycle-dependent, differential prenylation of proteins.
Pendolmycin, a new tumor promoter of the teleocidin A class on skin of CD-1 mice.
(Z,E)-α-farnesene: Major component of secretion from metathoracic scent gland of cotton seed bug,Oxycarenus hyalinipennis (Costa) (Heteroptera; Lygaeidae).
The essential oil from Thymus praecox ssp. arcticus growing in Iceland.
Effects of vitamin A and ascorbic acid on in vitro cholesterol biosynthesis in the rat.
Volatile constituents of Trichothecium roseum.
Publications by J-Stage
Characterization of Essential Oil from Citrus aurantium L. Flowers: Antimicrobial and Antioxidant Activities

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):HMDB39630
FooDB:FDB019258
Export Tariff Code:2915.39.9500
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

Suppliers

BOC Sciences

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 264.40856933594
Acid Value 1 max KOH/g
Vapor Pressure 0.000127 mmHg @ 25 °C
Vapor Density 1
Flash Point TCC Value 110 °C TCC
logP (o/w) 5.868 est
Solubility
alcohol Yes
water, 0.03852 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Floral
fresh, sweet, citrus, waxy, freesia, woody
Odor strength low
Substantivity 272 hour(s) at 100.00 %
Luebke, William tgsc, (1988) At 100.00 %. fresh sweet citrus waxy freesia woody
For a subtle sour lemon topnote in fragrances. A subtle woody, lemon drop odor

Occurrences

Safety Information

Safety information

European information :
Most important hazard(s):
None - None found.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
Pictogram
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Human Experience:
12% in petrolatum produced no irritation or sensitization.
Oral/Parenteral Toxicity:
oral-rat LD50 > 5000 mg/kg
For a subtle sour lemon topnote in fragrances.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
For a subtle sour lemon topnote in fragrances.

Inhalation Toxicity:
Not determined

Safety in use information

Category:
flavor and 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 nerolidyl acetate usage levels up to:
8.0000 % in the fragrance concentrate.

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):2306-78-7
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5363426
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
[(6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl] acetate
Chemidplus:0002306787