Articles:
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guavanate (Bedoukian)
Notes:
Used as a food additive [EAFUS]
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Bedoukian Research, Inc. Perfecting the Art of Chemistry Working closely with our customers to meet their requirements. Dr. Paul Bedoukian founded the company in 1972 to fill a niche as a supplier of high quality specialty aroma molecules. Today, we offer more than 350 high impact aroma chemicals, while providing custom manufacturing services to the pharmaceutical, agrochemical, and specialty chemical industries. US Email: Customer Service US Email: Customer Service US Voice: 1-203-830-4000 US Fax: 1-203-830-4010 Instagram Linkedin Recent News Products List: View Product(s): 493 GUAVANATE 98.0% (sum of isomers) Sweet, Juicy tropical fruit notes, aromatic, slightly woody impression with a creamy Coconut dry-down. Excels in mango and other tropical fruit compositions, adding complexity and depth.
Excellent for mango, guava, sweet part of durian, longan, grapefruit, melon, apple, banana, pineapple, and other tropical flavors. Also may be used for coconut and dairy flavors.
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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 Molecule and chiral compounds. BOC Sciences provides a wide range of services to support the pharmaceutical industry through all stages of drug discovery including Custom Synthesis of those chemicals that are not in stock, Isotope Labeling Service, Chiral Synthesis and Resolution, Bioconjugation, PEGylation services, analytical services. BOC Sciences is a brand of BOCSCI Inc. We leverage our wide spectrum of business in the fields of development, manufacturing, marketing, and distribution to help you make best-informed decisions tailored to your evolving needs for premium chemicals. Our complete suite of CRO services spans the entire molecule development pipeline including contract research for target identification, building blocks, compound synthesis, biochemical and cellular analysis, preclinical animal tests, and clinical studies. Email: Marketing US Email: Marketing Email: Sales US Email: Sales Voice: 1-631-485-4226 Fax: 1-631-614-7828 US Voice: 1-631-485-4226 US Fax: 1-631-614-7828 Europe 44-203-286-1088 Facebook Twitter Linkedin Blog Get the App! Product(s): 41654-15-3 GUAVANATE 98.0% (sum of isomers)
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Penta International Corporation Chemistry innovation At Penta, our products and services help businesses do business better. For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes. US Email: Technical Services US Email: Sales US Voice: (973) 740-2300 US Fax: (973) 740-1839 Product(s): 13-60550 METHYL CIS-5-OCTENOATE
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| Fragrance Demo Formulas | ||
| CAS Number: | 41654-15-3 |  3D/inchi
|
| FDA UNII: | OZK77KWP2S | |
| Nikkaji Web: | J2.301.964G | |
| XlogP3-AA: | 2.20 (est) | |
| Molecular Weight: | 156.22492000 | |
| Formula: | C9 H16 O2 | |
| NMR Predictor: | Predict (works with chrome, Edge or firefox) | |
Category: flavor and fragrance agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Perfumer and Flavorist: | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
| JECFA Food Flavoring: | 1630 methyl (Z)-5-octenoate |
| DG SANTE Food Flavourings: | 09.934 methyl (5Z)-octenoate |
| FEMA Number: | 4165 methyl cis-5-octenoate |
| FDA: | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF): | 41654-15-3 ; METHYL CIS-5-OCTENOATE |
Physical Properties:
| Appearance: | colorless clear liquid (est) |
| Assay: | 95.10 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.92100 to 0.92500 @ 25.00 °C. |
| Pounds per Gallon - (est).: | 7.664 to 7.697 |
| Refractive Index: | 1.43800 to 1.43200 @ 20.00 °C. |
| Boiling Point: | 184.00 to 185.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.425000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 164.00 °F. TCC ( 73.33 °C. ) |
| logP (o/w): | 2.908 (est) |
| Soluble in: | |
| alcohol | |
| water, slightly | |
| water, 158.9 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Type: fruity | |
| sweet fruity woody creamy | |
| Odor Description: at 100.00 %. | sweet fruity woody creamy |
| Flavor Type: dairy | |
| creamy dairy coconut tropical guava | |
| Taste Description: | creamy dairy coconut tropical guava |
| Odor and/or flavor descriptions from others (if found). | |
| Bedoukian Research | |
| GUAVANATE 98.0% (sum of isomers) | |
| Odor Description: | Sweet, fruity, slightly woody notes with creamy dry-down Sweet, Juicy tropical fruit notes, aromatic, slightly woody impression with a creamy Coconut dry-down. Excels in mango and other tropical fruit compositions, adding complexity and depth. |
| Taste Description: | Exotic, musty, tropical note, characteristic pink guava Excellent for mango, guava, sweet part of durian, longan, grapefruit, melon, apple, banana, pineapple, and other tropical flavors. Also may be used for coconut and dairy flavors. |
Cosmetic Information:
| None found |
Suppliers:
| Bedoukian Research |
| GUAVANATE 98.0% (sum of isomers)
Odor: Sweet, fruity, slightly woody notes with creamy dry-down Use: Sweet, Juicy tropical fruit notes, aromatic, slightly woody impression with a creamy Coconut dry-down. Excels in mango and other tropical fruit compositions, adding complexity and depth. Flavor: Exotic, musty, tropical note, characteristic pink guava Excellent for mango, guava, sweet part of durian, longan, grapefruit, melon, apple, banana, pineapple, and other tropical flavors. Also may be used for coconut and dairy flavors. |
| BOC Sciences |
| For experimental / research use only. |
| GUAVANATE 98.0% (sum of isomers) |
| Parchem |
| methyl (Z)-5-octenoate |
| Penta International |
| METHYL CIS-5-OCTENOATE |
Safety Information:
| 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. | |
| Oral/Parenteral Toxicity: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| 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 methyl (Z)-5-octenoate usage levels up to: | |||
| 1.0000 % in the fragrance concentrate. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 3.70 (μg/capita/day) | ||
| Modified Theoretical Added Maximum Daily Intake (mTAMDI): | 820 (μg/person/day) | ||
| Threshold of Concern: | 1800 (μg/person/day) | ||
| Structure Class: | I | ||
| Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS). | |||
| The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library | |||
| publication number: 22 | |||
| Click here to view publication 22 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | 0.50000 | 0.60000 | |
| beverages(nonalcoholic): | 0.20000 | 0.20000 | |
| beverages(alcoholic): | 0.20000 | 0.20000 | |
| breakfast cereal: | 0.50000 | 0.60000 | |
| cheese: | 0.50000 | 0.60000 | |
| chewing gum: | 5.00000 | 6.30000 | |
| condiments / relishes: | - | - | |
| confectionery froastings: | 0.50000 | 0.60000 | |
| egg products: | - | - | |
| fats / oils: | 1.00000 | 1.30000 | |
| fish products: | - | - | |
| frozen dairy: | 0.50000 | 0.60000 | |
| fruit ices: | 0.30000 | 0.30000 | |
| gelatins / puddings: | 0.50000 | 0.60000 | |
| granulated sugar: | 0.30000 | 0.30000 | |
| gravies: | - | - | |
| hard candy: | 1.00000 | 1.30000 | |
| imitation dairy: | 0.30000 | 0.30000 | |
| instant coffee / tea: | 0.20000 | 0.20000 | |
| jams / jellies: | 0.50000 | 0.60000 | |
| meat products: | - | - | |
| milk products: | 0.50000 | 0.60000 | |
| nut products: | - | - | |
| other grains: | - | - | |
| poultry: | - | - | |
| processed fruits: | - | - | |
| processed vegetables: | - | - | |
| reconstituted vegetables: | - | - | |
| seasonings / flavors: | 0.30000 | 0.30000 | |
| snack foods: | - | - | |
| soft candy: | 0.50000 | 0.60000 | |
| soups: | 0.30000 | 0.30000 | |
| sugar substitutes: | - | - | |
| sweet sauces: | 0.30000 | 0.30000 | |
| Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i). | |||
| Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm. | |||
| average usage mg/kg | maximum usage mg/kg | ||
| Dairy products, excluding products of category 02.0 (01.0): | 1.00000 | 3.00000 | |
| Fats and oils, and fat emulsions (type water-in-oil) (02.0): | 2.00000 | 5.00000 | |
| Edible ices, including sherbet and sorbet (03.0): | 1.00000 | 2.00000 | |
| Processed fruit (04.1): | 0.50000 | 1.00000 | |
| Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): | 0.50000 | 1.00000 | |
| Confectionery (05.0): | 1.00000 | 3.00000 | |
| Chewing gum (05.0): | - | - | |
| Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): | 2.00000 | 5.00000 | |
| Bakery wares (07.0): | 5.00000 | 10.00000 | |
| Meat and meat products, including poultry and game (08.0): | 5.00000 | 10.00000 | |
| Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): | 5.00000 | 10.00000 | |
| Eggs and egg products (10.0): | - | - | |
| Sweeteners, including honey (11.0): | - | - | |
| Salts, spices, soups, sauces, salads, protein products, etc. (12.0): | 1.00000 | 3.00000 | |
| Foodstuffs intended for particular nutritional uses (13.0): | 1.00000 | 3.00000 | |
| Non-alcoholic ("soft") beverages, excl. dairy products (14.1): | 0.20000 | 2.00000 | |
| Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): | 0.20000 | 2.00000 | |
| Ready-to-eat savouries (15.0): | 2.00000 | 5.00000 | |
| Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): | 1.00000 | 5.00000 | |
Safety References:
| European Food Safety Athority(EFSA): | Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... |
| European Food Safety Authority (EFSA) reference(s): | |
| Flavouring Group Evaluation 5, Revision 1 (FGE.05Rev1):Esters of branched- and straight-chain aliphatic saturated primary alcohols and of one secondary alcohol, and branched- and straight-chain unsaturated carboxylic acids from chemical groups 1, 2, and 5 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) [1] - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 71: Consideration of aliphatic, linear, alpha,beta-unsaturated carboxylic acids and related esters View page or View pdf | |
| Flavouring Group Evaluation 72 (FGE.72): Consideration of aliphatic, branched-chain saturated and unsaturated alcohols, aldehydes, acids, and related esters evaluated by the JECFA (61st meeting) structurally related to branched- and straight-chain unsaturated carboxylic acids. Esters of these and straight-chain aliphatic saturated alcohols evaluated by EFSA in FGE.05Rev2 (2010) View page or View pdf | |
| Flavouring Group Evaluation 5, Revision 2 (FGE.05Rev2): Branched- and straight-chain unsaturated carboxylic acids and esters of these with aliphatic saturated alcohols from chemical groups 1, 2, 3 and 5 View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 95 (FGE.95): Consideration of aliphatic, linear or branched-chain saturated and unsaturated alcohols, aldehydes, acids and related esters evaluated by JECFA (69th meeting) structurally related to esters of branched- and straight-chain aliphatic saturated primary alcohols and of one secondary alcohol, and branched- and straight-chain unsaturated carboxylic acids evaluated by EFSA in FGE.05Rev1 (2008) View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 5, Revision 3 (FGE.05Rev3): Branched- and straight-chain unsaturated aldehydes, dienals, unsaturated and saturated carboxylic acids and related esters with saturated and unsaturated aliphatic alcohols and a phenylacetic acid related ester from chemical groups 1, 2, 3, 5 and 15 View page or View pdf | |
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 6914062 |
| National Institute of Allergy and Infectious Diseases: | Data |
| methyl (Z)-oct-5-enoate | |
| Chemidplus: | 0041654153 |
References:
| methyl (Z)-oct-5-enoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 6914062 |
| Pubchem (sid): | 135329361 |
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 |
| FDA Substances Added to Food (formerly EAFUS): | View |
| HMDB (The Human Metabolome Database): | Search |
| FooDB: | FDB009851 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
Potential Uses:
| fruity |
Occurrence (nature, food, other): note
| mango fruit Search Trop Picture | |
| pineapple fruit Search Trop Picture | |
| snake fruit Search Trop Picture |
Synonyms:
| guavanate (Bedoukian) | |
| methyl (5Z)-oct-5-enoate | |
| methyl (5Z)-octenoate | |
| methyl (Z)-oct-5-enoate | |
| methyl cis-5-octenoate | |
| (5Z)-5- | octenoic acid methyl ester |
| 5- | octenoic acid, methyl ester, (5Z)- |