delta-damascone

1-2,6,6-trimethyl-3-cyclohexen-1-yl-2-buten-1-one

CAS: 57378-68-4 C13 H20 O MW: 192.30160000 floral woody

Identification

Namedelta-damascone
IUPAC1-(2,6,6-trimethyl-1-cyclohex-3-enyl)but-2-en-1-one
CAS Number57378-68-4
EINECS260-709-8
FDA UNII7F4RIE5P7E
Molecular FormulaC13 H20 O
Molecular Weight192.30160000
MDL NumberMFCD00489848
Nikkaji NumberJ65.767K
Beilstein1939321

Regulatory

JECFA Food Flavoring386 delta-damascone
DG SANTE Food Flavourings07.130 delta-damascone
FEMA Number3622
FDANo longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF)57378-68-4 ; DELTA-DAMASCONE

Physical Properties

Appearance colorless to pale yellow clear liquid (est)
Assay 96.50 to 100.00
Food Chemicals Codex Listed No
Specific Gravity 0.92000 to 0.94000 @ 25.00 °C., 0.92700 to 0.93500 @ 20.00 °C.
Pounds per Gallon - (est). 7.655 to 7.822
Pounds per Gallon - est. 7.723 to 7.789
Refractive Index 1.48500 to 1.50200 @ 20.00 °C.
Boiling Point 263.59 °C. @ 760.00 mm Hg (est)
Acid Value 1.00 max. KOH/g
Vapor Pressure 0.010000 mmHg @ 25.00 °C. (est)
Flash Point > 212.00 °F. TCC ( > 100.00 °C. )
logP (o/w) 4.200
Shelf Life 36.00 month(s) or longer if stored properly.
Storage store in cool, dry place in tightly sealed containers, protected from heat and light.
Soluble in alcohol
Stability fine fragrances: traces - 0.1%

Cosmetic Information

CosIng['cosmetic data2', 'cosmetic data']
Cosmetic Usesfragrance

Organoleptic Properties

Odor Strength high ,
Substantivity 220 hour(s) at 100.00 %
Odor Description
at 10.00 % in dipropylene glycol.
Woody, minty, sweet and fruity, with a brown herbal nuance
Blackcurrant (cassis), fruity note of exceptional diffusion. Very good in trace amounts a rose/tobacco effect. Member of the rose ketone family. A fruity, apple, rose earthy note
A diffusive rosy note. More fruity and less rosy than DAMASCONE ALPHA
powerful, fruity (black currant, cassis), floral; less natural than beta-damascone or damascenone
Earthy, Floral, Fruity, Tobacco, Woody
Fruity-plum, apple, sweet-rose, natural, cassis, tobacco
Odor sample from International Flavors & Fragrances Inc.
Taste Description at 30.00 ppm.

Safety Information

European informationMost important hazard(s):
Oral/Parenteral Toxicityoral-mouse LD50 1821 mg/kg
Dermal ToxicityNot determined
Inhalation ToxicityNot determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categoryflavor and fragrance agents
RIFM Fragrance Material Safety AssessmentSearch
IFRA Critical EffectDermal sensitization
fragrance material specificationShould not be used as fragrance ingredients such that the total level in finished cosmetic products exceeds 0.02%, individually or in combination. Based on test data showing sensitising potential for these materials and on evidence of cross-reactivity. (IFRA guidelines)
IFRA RESTRICTION LIMITS IN THE FINISHED PRODUCT (%)Category 1: Products applied to the lips
NotesIFRA FLAVOR REQUIREMENTS:
use level in formulae for use in cosmetics0.0940 %
Dermal Systemic Exposure in Cosmetic Products0.0024 mg/kg/day (IFRA, 2002)
Maximised Survey-derived Daily Intakes (MSDI-EU)0.31 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA)0.60 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI)2.57 (μg/person/day)
Structure ClassI
baked goods-
beverages(nonalcoholic)-
beverages(alcoholic)-
breakfast cereal-
cheese-
chewing gum-
condiments / relishes-
confectionery froastings-
egg products-
fats / oils-
fish products-
frozen dairy-
fruit ices-
gelatins / puddings-
granulated sugar-
gravies-
hard candy-
imitation dairy-
instant coffee / tea-
jams / jellies-
meat products-
milk products-
nut products-
other grains-
poultry-
processed fruits-
processed vegetables-
reconstituted vegetables-
seasonings / flavors-
snack foods-
soft candy-
soups-
sugar substitutes-
sweet sauces-
Dairy products, excluding products of category 02.0 (01.0)-
Fats and oils, and fat emulsions (type water-in-oil) (02.0)-
Edible ices, including sherbet and sorbet (03.0)-
Processed fruit (04.1)-
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2)-
Confectionery (05.0)0.01000
Chewing gum (05.3)-
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0)0.00500
Bakery wares (07.0)0.00500
Meat and meat products, including poultry and game (08.0)-
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0)-
Eggs and egg products (10.0)-
Sweeteners, including honey (11.0)-
Salts, spices, soups, sauces, salads, protein products, etc. (12.0)-
Foodstuffs intended for particular nutritional uses (13.0)-
Non-alcoholic ("soft") beverages, excl. dairy products (14.1)0.00500
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2)-
Ready-to-eat savouries (15.0)-
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0)-

ACS International GmbH

Creativity Beyond Chemistry

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Associate Allied Chemicals

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Augustus Oils Ltd

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View All Website +44 (0)1420 590555 essentials@augustus-oils.ltd.uk

Azelis UK Ltd.

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Berje Inc.

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Where the world comes to its senses - Berjé is a global distributor of Essential Oils and Aromatic Chemicals.

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BOC Sciences

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Firmenich Inc.

We Create

We create perfumes and flavors for the World's most desirable brands.

View All Website +1 609 452 1000 Frederick.Keifer@firmenich.com

Foreverest Resources Ltd.

Leading pine based chemicals supplier

Supplying turpentine based and natural/extracted flavor & fragrance ingredients.

View All Website +86 (0)592 5105533 info@foreverest.cn

Global Essence Inc.

Preferred Partner

Accommodate each customers unique needs.

View All Website 001 732 677 1100 info@globalessenceuk.com

Indukern, S.A. F&F Ingredients Division

Commitment to quality

Idukern F&F Ingredients is your partner for the fragrance and flavor ingredients.

View All Website +34 93 506 91 00 info@indukern.es

Lluch Essence S.L.

A family company dedicated to sales and distribution

Flexibility, availability, price and quality.

View All Website 34 93 379 38 49 web@lluche.com

M&U International LLC

Steady supply & demand

Meeting customers increasing demands at home as well as abroad.

View All Website 908-359-9000 sales@mu-intel.com

Moellhausen S.P.A.

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OQEMA

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Pell Wall Perfumes

Hand-made fragrances

Pell Wall maintains a broad palette of ingredients & in order to keep stocks fresh & the options wide we also sell from our own stock.

View All Website +44 (0) 20 3745 0887 https://pellwall.com/contact-us/

Penta International Corporation

Chemistry innovation

At Penta, our products and services help businesses do business better.

View All Website (973) 740-2300 lisaa@pentamfg.com

SRS Aromatics Ltd

For over 25 years

Bringing flavour and fragrance into your world.

View All Website +44 (0) 1284 704076 info@srsaromatics.co.uk

Taytonn ASCC Pte Ltd

Supplying Asia Pacific

We fully understand the demands of the F&F industry and we endeavour to supply quality products, with ready availability and a personalised service.

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The John D. Walsh Company, Inc

Suppliers Since 1942

Supplying the fragrance and flavor industry with high quality products.

View All Website 973-962-1400 info@johndwalsh.com

The Lermond Company

Your Sourcing Resource

The Lermond family has been sourcing raw materials for the flavor and fragrance industry for nearly 7 decades.

View All Website 201-896-3300 info@lermond.com

R C Treatt and Co Ltd

Innovative ingredient solutions

World-leading innovative ingredient solutions provider for the flavour, fragrance and FMCG industries.

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Ernesto Ventós S.A.

Leaders in essence

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Vigon International

Passion for Simplicity

Manufacturer and supplier of high quality flavor and fragrance ingredients.

View All Website 570-476-6300 sales@vigon.com

Zanos Ltd.

Distributor of Speciality Chemicals and Natural Ingredients

Sourcing and supplying quality aroma chemicals and prestige natural ingredients for the flavour and fragrance industry.

View All Website +44 (0) 1565 755899 sales@zanos.co.uk

Potential Uses

FR acacia FR agrumen aldehyde FR aldehydic FR crabapple FR apple red apple FR ash mountain ash berry FR berry jam FR blackberry blossom tropical blossom FR boxwood FR boysenberry FR bramble arctic bramble blackberry FR butterscotch FR cedar forest FR chamomile FR cherry black cherry FR christmas FR chrysanthemum FL cloudberry bakeapple FR crabapple blossom FR cranberry FR currant black currant FL/FR currant bud absolute replacer FR date FR davana oil replacer diffusion FR eglantine FR elder berry FR fig FR floral fruit dried fruit FL fruit tropical fruit FR grape FR guava FR herbal FR hibiscus FR honey FR honeysuckle FR hugonia FL/FR immortelle FR kiwi FR kiwi blossom FR lychee FR mango FL/FR marigold FL/FR marjoram FL necterine FR pansy FR passion blossom FR passion fruit FR pear FR pear blossom FL pear emperor pear plum jam FR plum mirabelle plum FR pomegranate FR prune FR raisin FR raspberry raspberry jam FR redwood FR rose FR rose tea rose rose wild rose FL/FR rue FR stephanotis FR tangerine FL tea FR tobacco FL tropical watercress nasturtium FR woody FR wormwood oil replacer FL/FR yerba mate

Natural Occurrence

not found in nature

Synonyms

2- buten-1-one, 1-(2,6,6-trimethyl-3-cyclohexen-1-yl)- 8- damascone delta- damascone damascone delta damascone, delta dihydro floriffone TD delta- rose ketone rose ketone delta rose ketone-3 1-(2,6,6- trimethyl-1-cyclohex-3-enyl)but-2-en-1-one 1-2,6,6- trimethyl-3-cyclohexen-1-yl-2-buten-1-one 1-(2,6,6- trimethyl-3-cyclohexen-1-yl)-2-buten-1-one 1-(2β,6,6- trimethyl-3-cyclohexen-1a-yl)-2-butene-1-one 1-(2,6,6- trimethylcyclohex-3-en-1-yl)but-2-en-1-one US Patents: Use of hydrogenated derivatives of 2,6,6-trimethyl-cyclohexene derivatives in augmenting or enhancing the aroma or taste of smoking tobacco and smoking tobacco articles PubMed: Analytical and sensory characterization of the aroma of "Langhe D.O.C. Nebbiolo" wines: influence of the prefermentative cold maceration with dry ice. J-Stage: Identification of (3S, 9R)- and (3S, 9S)-Megastigma-6,7-dien-3,5,9-triol 9-O-ß-D-glucopyranosides as Damascenone Progenitors in the PubMed: Aromatic aldols and 1,5-diketones as optimized fragrance photocages. PubMed: Influence of the backbone structure on the release of bioactive volatiles from maleic acid-based polymer conjugates. PubMed: Substrate promiscuity of RdCCD1, a carotenoid cleavage oxygenase from Rosa damascena. PubMed: Synthetic applications of enantioselective protonation and case study for (S)-alpha-damascone. PubMed: Characterization of the most odor-active compounds in an American Bourbon whisky by application of the aroma extract dilution analysis. PubMed: Fragrance material review on delta-damascone. PubMed: Fragrance material review on trans,trans-delta-damascone. PubMed: Glycosidically bound volatiles and flavor precursors in Laurus nobilis L. PubMed: Aroma extract dilution analysis of cv. Meeker (Rubus idaeus L.) red raspberries from Oregon and Washington. PubMed: Identification of (3S, 9R)- and (3S, 9S)-megastigma-6,7-dien-3,5,9-triol 9-O-beta-D-glucopyranosides as damascenone progenitors in the flowers of Rosa damascena Mill. PubMed: Character impact odorants of the apple cultivars Elstar and Cox Orange. PubMed: Acid-catalyzed hydrolysis of alcohols and their beta-D-glucopyranosides. PubMed: C(13)-Norisoprenoid glucoconjugates from lulo (Solanum quitoense L.) leaves. PubMed: Bioconversion of alpha-Damascone by Botrytis cinerea.