Identification

Namegrape butyrate
IUPACethyl 3-hydroxybutanoate
CAS Number5405-41-4
EINECS226-456-2
FDA UNII52008C87PV
Molecular FormulaC6 H12 O3
Molecular Weight132.15924000
MDL NumberMFCD00004545
Nikkaji NumberJ140.266H
Beilstein1446190
CoE Number10596

Regulatory

JECFA Food Flavoring594 ethyl 3-hydroxybutyrate
DG SANTE Food Flavourings09.522 ethyl 3-hydroxybutyrate
FEMA Number3428
FDANo longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF)5405-41-4 ; ETHYL 3-HYDROXYBUTYRATE

Physical Properties

Appearance colorless clear viscous liquid (est)
Assay 96.00 to 100.00
Food Chemicals Codex Listed No
Specific Gravity 1.00900 to 1.01900 @ 25.00 °C., 1.01200 to 1.01600 @ 20.00 °C.
Pounds per Gallon - (est). 8.396 to 8.479
Pounds per Gallon - est. 8.431 to 8.464
Refractive Index 1.41500 to 1.42500 @ 20.00 °C., 1.42000 to 1.42300 @ 20.00 °C.
Boiling Point 170.00 to 175.00 °C. @ 760.00 mm Hg, 81.00 °C. @ 18.00 mm Hg
Vapor Pressure 0.362000 mmHg @ 25.00 °C. (est)
Flash Point 142.00 °F. TCC ( 61.11 °C. )
logP (o/w) 0.098 (est)
Shelf Life 12.00 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
Insoluble in water

Cosmetic Information

CosIngcosmetic data
Cosmetic Usesperfuming agents

Organoleptic Properties

Odor Strength medium
Substantivity 4 hour(s) at 100.00 %
Odor Description
at 100.00 %.
Fruity, grape-like with green waxy nuances, apple skin like
Fresh, Fruity, Grape
Mild ethereal, fruity odor with black currant reminiscence
Mild etheral fruity odor, with blackcurrant reminiscence
Odor sample from Alfrebro LLC/ Archer Daniels Midland Company
Taste Description
at 30.00 ppm.
green fruity wine
Fruity winey taste with reminiscence of pineapple and strawberry

Safety Information

Preferred SDSView
European informationMost important hazard(s):
Oral/Parenteral ToxicityNot determined
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
Recommendation for grape butyrate usage levels up to2.0000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU)7.90 (μg/capita/day)
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-

Advanced Biotech. Inc.

Inspired by Nature

A diverse range of products, all meeting our stringent commitment to quality.

View All Website 973-339-6242 info@adv-bio.com

Alfrebro LLC/ Archer Daniels Midland Company

Let's get reacquainted

Building great taste with aroma chemicals, extracts, and distillates

View All Website 513-539-7373 sforbis@alfrebro.com

Beijing Lys Chemicals Co, LTD.

From Grams to Tons

Fine chemical high-tech company which contains R&D, production, and sales.

View All Website 86-10-68418738 jiayanyong@lyschem.com

BOC Sciences

Best of Chemicals Supplier

Quality supplier of research chemicals and biochemicals including inhibitors, building blocks, GMP Products, impurities and metabolites, APIs for Veterinary, Natural Compounds, ADCs, Stem Cell Molecul...

View All Website 1-631-485-4226 account@bocsci.com

FCI SAS

Inspired by Nature

At FCI customer service is not a department it’s an attitude.

View All Website +33 (0)1 34 25 58 10 info@fcifr.com

FRUTAROM USA INC,

Flavor & Specialty Ingredients

Your preferred partner for flavour and fragrance success.

View All Website +44 (0) 1429 863 222 Sales.IFFIngredients@iff.com

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

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

Sigma-Aldrich

Complete Supply Chain

The perfect blend of products and services that bring your creativity to life.

View All Website 800-244-1173 ff@sial.com

Sunaux International

Buy With Confidence

We have industry leading processes and procedures to ensure nothing but the most reliable product.

View All Website 0512-57995626 johnjft@sunaux.com

Synerzine, Inc.

Innovation. Customization. Aroma Ingredients.

Synerzine is a leading supplier of flavor and fragrance ingredients.

View All Website (404) 524-6744 info@synerzine.com

TCI AMERICA

Moving Your Chemistry Forward

We continuously strive to advance our technology.

View All Website 1-800-423-8616 Sales-US@TCIchemicals.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

Tianjin Danjun International Trade Co., LTD.

Quality Products

We know the Chinese chemical market well.

View All Website +86-15822601686 songshasha@danjunchem.com

R C Treatt and Co Ltd

Innovative ingredient solutions

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

View All Website +1 863 668 9500 enquiries@treatt.com

Ernesto Ventós S.A.

Leaders in essence

We employ our five senses to do our job well.

View All Website +1 856 226 7501 info@ventos.com

WholeChem, LLC

Connecting Innovators To the Building Blocks Of the Universe

Custom manufacturer and distributor of specialty ingredients. We make global local.

View All Website +1 (262) 995.8668 info@wholechem.com

Potential Uses

FR apple FR apricot FR berry FL fruit tropical fruit FR grape FR pineapple FR wine

Natural Occurrence

blackberry fruit PMC grape guava fruit mango fruit passion fruit rum PMC tea black tea tea leaf wine wine strawberry wine

Synonyms

butanoic acid, 3-hydroxy-, ethyl ester butanoic acid, 3-hydroxy-, ethyl ester, (±)- butyric acid, 3-hydroxy-, ethyl ester ethoxiff ethyl (±)-3-hydroxybutyrate ethyl (1)-3-hydroxybutyrate ethyl 3 hydroxy butyrate ethyl 3-hydroxy butyrate ethyl 3-hydroxybutanoate ethyl 3-hydroxybutyrate ethyl 3-hydroxybutyrate (natural) ethyl 3-hydroxybutyrate natural ethyl 3-hydroxybutyrate synthetic ethyl beta-hydroxybutyrate ethyl DL-3-hydroxybutyrate ethyl-3-hydroxy butyrate ethyl-3-hydroxybutyrate ethyl-3-hydroxybutyrate natural grape butyrate 3- hydroxy-butyric acid ethyl ester 3- hydroxybutanoic acid ethyl ester 3- hydroxybutyric acid ethyl ester Perfumer & Flavorist: Ethyl-3-hydroxybutyrate PubMed: Behavioural responses of Tribolium castaneum (Herbst) to volatiles identified from dry cocoa beans. PubMed: A two-step enzymatic resolution process for large-scale production of (S)- and (R)-ethyl-3-hydroxybutyrate. PubMed: A useful approach for the differentiation of wines according to geographical origin based on global volatile patterns. PubMed: Study of sensory interactions among red wine fruity esters in a model solution. PubMed: Pomegranate juice adulteration by addition of grape or peach juices. PubMed: Identification and field evaluation of fermentation volatiles from wine and vinegar that mediate attraction of spotted wing Drosophila, Drosophila suzukii. PubMed: Hypoxia induces H2O2 production and activates antioxidant defence system in grapevine buds through mediation of H2O2 and ethylene. PubMed: The lipid-lowering effect of dietary proanthocyanidins in rats involves both chylomicron-rich and VLDL-rich fractions. PubMed: Feasibility of hydrogen production from ripened fruits by a combined two-stage (dark/dark) fermentation system. PubMed: NMR metabolomics of esca disease-affected Vitis vinifera cv. Alvarinho leaves. PubMed: beta-aminobutyric acid primes an NADPH oxidase-dependent reactive oxygen species production during grapevine-triggered immunity. PubMed: Changes in the levels of indoleamine phytochemicals during véraison and ripening of wine grapes. PubMed: Synthesis and bioassay of racemic and chiral trans-alpha-necrodyl isobutyrate, the sex pheromone of the grape mealybug Pseudococcus maritimus. PubMed: Synthesis of gamma-aminobutyric acid (GABA) by Lactobacillus plantarum DSM19463: functional grape must beverage and dermatological applications. PubMed: Characterization of fermentative behaviors of lactic acid bacteria in grape wines through 1H NMR- and GC-based metabolic profiling. PubMed: Examples of perceptive interactions involved in specific "red-" and "black-berry" aromas in red wines. PubMed: A substitutive substrate for measurements of beta-ketoacyl reductases in two fatty acid synthase systems. PubMed: (1)H NMR metabolite profiling of feces as a tool to assess the impact of nutrition on the human microbiome. PubMed: Behavioural responses of Tribolium castaneum (Herbst) to volatiles identified from dry cocoa beans. PubMed: Changes in somatosensory-evoked potentials and high-frequency oscillations after paired-associative stimulation. PubMed: beta-Aminobutyric acid-induced resistance against downy mildew in grapevine acts through the potentiation of callose formation and jasmonic acid signaling. PubMed: The presence of gamma-hydroxybutyric acid (GHB) and gamma-butyrolactone (GBL) in alcoholic and non-alcoholic beverages. PubMed: Stir bar sorptive extraction applied to volatile constituents evolution during Vitis vinifera ripening. PubMed: Resolution enhancement in in vivo NMR spectroscopy: detection of intermolecular zero-quantum coherences. PubMed: Novel natural ligands for Drosophila olfactory receptor neurones. PubMed: A two-step enzymatic resolution process for large-scale production of (S)- and (R)-ethyl-3-hydroxybutyrate. PubMed: Free and bound volatile composition and characterization of some glucoconjugates as aroma precursors in melón de olor fruit pulp (Sicana odorifera). PubMed: A short, stereoselective synthesis of (3R,4R)-4-acetoxy-3-[(R)-1'((t-butyldimethylsilyl)oxy)ethyl]-2-azetidin one, key intermediate for the preparation of carbapenem antibiotics. PubMed: Chemometric optimization of an asymmetric reduction catalyzed by baker's yeast.