(Z)-3-hexen-1-yl salicylate
cis-3-hexenyl salicylate
Identification
| Name | (Z)-3-hexen-1-yl salicylate |
| IUPAC | [(Z)-hex-3-enyl] 2-hydroxybenzoate |
| CAS Number | 65405-77-8 |
| EINECS | 265-745-8 |
| FDA UNII | C78Y9OR6YH |
| Molecular Formula | C13 H16 O3 |
| Molecular Weight | 220.26812000 |
| MDL Number | MFCD00036486 |
| Nikkaji Number | J76.332B |
| CoE Number | 10685 |
| XlogP3 | 4.40 (est) |
Regulatory
| DG SANTE Food Flavourings | 09.570 (Z)-hex-3-enyl salicylate |
| FEMA Number | 4750 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
Physical Properties
| Appearance | colorless clear oily liquid (est) |
| Assay | 98.00 to 100.00 sum of isomers |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 1.05700 to 1.06500 @ 25.00 °C., 1.05700 to 1.06500 @ 20.00 °C. |
| Pounds per Gallon - (est). | 8.795 to 8.862 |
| Pounds per Gallon - est. | 8.806 to 8.872 |
| Refractive Index | 1.51800 to 1.52200 @ 20.00 °C. |
| Melting Point | 139.00 °C. @ 760.00 mm Hg |
| Boiling Point | 145.00 °C. @ 5.00 mm Hg, 394.00 °C. @ 760.00 mm Hg |
| Vapor Pressure | 0.000246 mmHg @ 25.00 °C. (est) |
| Vapor Density | >1 ( Air = 1 ) |
| Flash Point | 230.00 °F. TCC ( 110.00 °C. ) |
| logP (o/w) | 4.630 |
| Shelf Life | 24.00 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 |
| Stability | acid cleaner |
| Similar Items | note |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | perfuming agents |
Organoleptic Properties
| Odor Strength | medium |
| Substantivity | 216 hour(s) at 100.00 % |
| Odor Description |
at 100.00 %. A floral (lily of the valley) green note Apparently mild odored in the herbaceous/green family, but an excellent blending agent. Floral, sea herbaceous, curative, woody, skin green aromatic floral phenolic-medicinal leathery-mossy Fresh, sweet-floral, green-balsamic, salicylate Fresh, floral fragrance with green herbaceous and balsamic shades Green, salicylate, floral, sweet
|
| Odor sample from | Bedoukian Research, Inc. |
| Taste Description |
green melon fruity floral metallic herbal cilantro soapy vegetable fruity floreal, medicinal, ethereal sweet, green, floral, woody and balsamic sweet, green, floral, woody and balsamic
|
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| Oral/Parenteral Toxicity | oral-rat LD50 5000 mg/kg |
| Dermal Toxicity | skin-rabbit LD50 > 5000 mg/kg |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | flavor and fragrance agents |
| RIFM Fragrance Material Safety Assessment | Search |
| maximum skin levels for fine fragrances | 2.0200 % and are based on the assumption that the fragrance mixture is used at 20% in a consumer product (IFRA Use Level Survey). (IFRA, 2002) |
| Recommendation for (Z)-3-hexen-1-yl salicylate usage levels up to | 5.0000 % in the fragrance concentrate. |
| use level in formulae for use in cosmetics | 3.9611 % |
| Dermal Systemic Exposure in Cosmetic Products | 0.1009 mg/kg/day (IFRA, 2002) |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 0.13 (μg/capita/day) |
| Modified Theoretical Added Maximum Daily Intake (mTAMDI) | 3900 (μg/person/day) |
| Threshold of Concern | 1800 (μg/person/day) |
| Structure Class | I |
| baked goods | 0.30000 |
| beverages(nonalcoholic) | 0.15000 |
| beverages(alcoholic) | 0.15000 |
| breakfast cereal | 0.30000 |
| cheese | - |
| chewing gum | 0.50000 |
| condiments / relishes | - |
| confectionery froastings | 0.50000 |
| egg products | - |
| fats / oils | - |
| fish products | - |
| frozen dairy | 0.50000 |
| fruit ices | 0.50000 |
| gelatins / puddings | 0.50000 |
| granulated sugar | - |
| gravies | - |
| hard candy | 0.50000 |
| imitation dairy | 0.50000 |
| instant coffee / tea | - |
| jams / jellies | 0.50000 |
| meat products | - |
| milk products | 0.50000 |
| nut products | 0.50000 |
| other grains | 0.50000 |
| poultry | - |
| processed fruits | 0.50000 |
| processed vegetables | - |
| reconstituted vegetables | - |
| seasonings / flavors | 0.50000 |
| snack foods | 0.50000 |
| soft candy | 0.50000 |
| soups | - |
| sugar substitutes | - |
| sweet sauces | 0.50000 |
| Dairy products, excluding products of category 02.0 (01.0) | 7.00000 |
| Fats and oils, and fat emulsions (type water-in-oil) (02.0) | 5.00000 |
| Edible ices, including sherbet and sorbet (03.0) | 10.00000 |
| Processed fruit (04.1) | 7.00000 |
| Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2) | - |
| Confectionery (05.0) | 10.00000 |
| Chewing gum (05.3) | - |
| Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0) | 5.00000 |
| Bakery wares (07.0) | 10.00000 |
| Meat and meat products, including poultry and game (08.0) | 2.00000 |
| Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0) | 2.00000 |
| Eggs and egg products (10.0) | - |
| Sweeteners, including honey (11.0) | - |
| Salts, spices, soups, sauces, salads, protein products, etc. (12.0) | 5.00000 |
| Foodstuffs intended for particular nutritional uses (13.0) | 10.00000 |
| Non-alcoholic ("soft") beverages, excl. dairy products (14.1) | 5.00000 |
| Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2) | 10.00000 |
| Ready-to-eat savouries (15.0) | 20.00000 |
| Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0) | 5.00000 |
Advanced Biotech. Inc.
Inspired by Nature
A diverse range of products, all meeting our stringent commitment to quality.
Augustus Oils Ltd
The Premier Supplier
Augustus Oils Ltd, in harmony with nature - to present it at its best...
Azelis UK Ltd.
Chemical Distribution
Azelis is a leading global distributor of speciality chemicals.
Bedoukian Research, Inc.
Perfecting the Art of Chemistry
Working closely with our customers to meet their requirements.
Berje Inc.
Where the world comes to its senses
Where the world comes to its senses - Berjé is a global distributor of Essential Oils and Aromatic Chemicals.
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...
ECSA Chemicals
Human Chemistry
ECSA Chemicals has been active since 1913 in the trading and international commerce of raw materials. With an organisation divided into industrial segments managed by specialists, it has become one of...
Indukern, S.A. F&F Ingredients Division
Commitment to quality
Idukern F&F Ingredients is your partner for the fragrance and flavor ingredients.
Jiangyin Healthway International Trade Co., Ltd
Independent Ingredients Supplier
We provide custom synthesis and contract manufacturing from milligrams to metric tonnes.
Lluch Essence S.L.
A family company dedicated to sales and distribution
Flexibility, availability, price and quality.
M&U International LLC
Steady supply & demand
Meeting customers increasing demands at home as well as abroad.
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.
Penta International Corporation
Chemistry innovation
At Penta, our products and services help businesses do business better.
Prodasynth
PRODUCTEUR PAR ESSENCE
Chemical specialist in manufacturing, distributing and sourcing of tailor-made ingredients for the Flavour & Fragrance industry.
Sunaux International
Buy With Confidence
We have industry leading processes and procedures to ensure nothing but the most reliable product.
Symrise AG
Always Insiring More
Symrise aroma molecules & cosmetic ingredients for unique and innovative fragrances, flavors and cosmetics.
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.
The John D. Walsh Company, Inc
Suppliers Since 1942
Supplying the fragrance and flavor industry with high quality products.
The Lermond Company
Your Sourcing Resource
The Lermond family has been sourcing raw materials for the flavor and fragrance industry for nearly 7 decades.
R C Treatt and Co Ltd
Innovative ingredient solutions
World-leading innovative ingredient solutions provider for the flavour, fragrance and FMCG industries.
Vigon International
Passion for Simplicity
Manufacturer and supplier of high quality flavor and fragrance ingredients.
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.