Articles:
N-isobutyldeca-trans-2-trans-4-dienamide
Notes:
consists of piper sylvaticum roxb. Constit. of Achillea millefolium (yarrow)
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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): 18836-52-7 Pellitorine
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Chemical sources Association Inc Exchange of knowledge Need This Item for Flavor? You can contact the Chemical Sources Association. Events Links Product(s):
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Glentham Life Sciences Ltd The Chemical, Biochemical & Research Essentials Supplier Glentham Life Sciences is a supplier of fine chemicals and raw materials with warehousing, laboratories and packaging facilities in the UK. With a Glentham Life Sciences account you can view more product details, request quotes and order products online. Email: Info Email: Sales Email: Tech Support Voice: +44 (0) 1225 667798 Fax: +44 (0) 2033 978909 Facebook Twitter Linkedin Google+ News Distribution Products List: View Product(s): GL4065 Pellitorine
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| CAS Number: | 18836-52-7 |  3D/inchi
|
| Other(deleted CASRN): | 53608-76-7 | |
| FDA UNII: | 8IS5231171 | |
| Nikkaji Web: | J10.444B | |
| Beilstein Number: | 1725967 | |
| MDL: | MFCD01735995 | |
| XlogP3-AA: | 4.40 (est) | |
| Molecular Weight: | 223.35945000 | |
| Formula: | C14 H25 N O | |
| BioActivity Summary: | listing | |
| NMR Predictor: | Predict (works with chrome 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: | 1598 N-isobutyl (E,E)-2,4-decadienamide |
| DG SANTE Food Flavourings: | 16.091 deca-(2E,4E)-dienoic acid isobutyl-amide |
| FEMA Number: | 4148 N-isobutyldeca-trans-2-trans-4-dienamide |
| FDA: | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF): | 18836-52-7 ; N-ISOBUTYLDECA-TRANS-2-TRANS-4-DIENAMIDE |
Physical Properties:
| Appearance: | colorless to pale yellow solid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Melting Point: | 82.00 to 90.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 368.00 to 369.00 °C. @ 760.00 mm Hg |
| Acid Value: | 5.00 max. KOH/g |
| Flash Point: | 436.00 °F. TCC ( 224.44 °C. ) |
| logP (o/w): | 3.943 (est) |
| Soluble in: | |
| alcohol | |
| water, 8.513 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Type: spicy | |
| spicy herbal | |
| Odor Description: at 1.00 % in dipropylene glycol. | spicy herbal |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| Axsyn |
| For experimental / research use only. |
| 2,4-Decadienamide,N-(2-methylpropyl)-, (2E,4E)- |
| BOC Sciences |
| For experimental / research use only. |
| Pellitorine |
| Glentham Life Sciences |
| Pellitorine |
| Parchem |
| isobutyl (E,E)-2,4-decadienamide |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| Pellitorine |
| Chemical Sources Association |
| Need This Item for Flavor/Food?: You can contact the CSA |
Safety Information:
| Preferred SDS: View | |
| 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 | ||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| Recommendation for isobutyl (E,E)-2,4-decadienamide usage levels up to: | |||
| 0.2000 % in the fragrance concentrate. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 6.10 (μg/capita/day) | ||
| Maximised Survey-derived Daily Intakes (MSDI-USA): | 83.00 (μg/capita/day) | ||
| Modified Theoretical Added Maximum Daily Intake (mTAMDI): | 770 (μg/person/day) | ||
| Threshold of Concern: | 90 (μg/person/day) | ||
| Structure Class: | III | ||
| 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: | - | - | |
| beverages(nonalcoholic): | 10.00000 | 25.00000 | |
| beverages(alcoholic): | 20.00000 | 100.00000 | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | 300.00000 | 500.00000 | |
| condiments / relishes: | 10.00000 | 50.00000 | |
| confectionery froastings: | 10.00000 | 30.00000 | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | - | |
| fruit ices: | 10.00000 | 25.00000 | |
| gelatins / puddings: | - | - | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | 25.00000 | 100.00000 | |
| imitation dairy: | - | - | |
| instant coffee / tea: | 10.00000 | 20.00000 | |
| jams / jellies: | - | - | |
| meat products: | 25.00000 | 50.00000 | |
| milk products: | - | - | |
| nut products: | - | - | |
| other grains: | - | - | |
| poultry: | - | - | |
| processed fruits: | - | - | |
| processed vegetables: | - | - | |
| reconstituted vegetables: | - | - | |
| seasonings / flavors: | 200.00000 | 2000.00000 | |
| snack foods: | 20.00000 | 100.00000 | |
| soft candy: | 25.00000 | 50.00000 | |
| soups: | 10.00000 | 30.00000 | |
| sugar substitutes: | - | - | |
| sweet sauces: | - | - | |
| 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): | 0.02000 | 1.00000 | |
| Fats and oils, and fat emulsions (type water-in-oil) (02.0): | 0.02000 | 1.00000 | |
| Edible ices, including sherbet and sorbet (03.0): | 0.20000 | 10.00000 | |
| Processed fruit (04.1): | - | - | |
| Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): | - | - | |
| Confectionery (05.0): | 2.00000 | 100.00000 | |
| Chewing gum (05.0): | - | - | |
| Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): | - | - | |
| Bakery wares (07.0): | 0.20000 | 10.00000 | |
| Meat and meat products, including poultry and game (08.0): | 0.02000 | 1.00000 | |
| Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): | 0.02000 | 1.00000 | |
| Eggs and egg products (10.0): | - | - | |
| Sweeteners, including honey (11.0): | - | - | |
| Salts, spices, soups, sauces, salads, protein products, etc. (12.0): | 0.02000 | 1.00000 | |
| Foodstuffs intended for particular nutritional uses (13.0): | - | - | |
| Non-alcoholic ("soft") beverages, excl. dairy products (14.1): | 2.00000 | 100.00000 | |
| Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): | 2.00000 | 100.00000 | |
| Ready-to-eat savouries (15.0): | 0.02000 | 1.00000 | |
| Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): | 0.02000 | 1.00000 | |
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 86, (FGE.86)[1] - Consideration of aliphatic and aromatic amines and amides evaluated by JECFA (65th meeting) - Scientific Opinion of the Panel on Food Additives - Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 86, Revision 1 (FGE.86Rev1): Consideration of aliphatic and aromatic amines and amides evaluated by JECFA (65th meeting) View page or View pdf | |
| Statement on List of Representative Substances for Testing.
The current Statement lays down a list of substances in sub-groups with representative substances for which additional data are required prior to their evaluation through the Procedure (Regulation (EC) No 1565/2000). View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 86, Revision 2 (FGE.86Rev2): Consideration of aliphatic and arylalkyl amines and amides evaluated by JECFA (65th meeting) View page or View pdf | |
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA GENetic TOXicology: | Search |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 5318516 |
| National Institute of Allergy and Infectious Diseases: | Data |
| (2E,4E)-N-(2-methylpropyl)deca-2,4-dienamide | |
| Chemidplus: | 0018836527 |
References:
| (2E,4E)-N-(2-methylpropyl)deca-2,4-dienamide | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 5318516 |
| Pubchem (sid): | 135204802 |
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 |
| CHEBI: | View |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | HMDB30951 |
| FooDB: | FDB002929 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
Potential Uses:
| arnica flower | FR | |
| caraway seed | FL/FR | |
| coriander | FL/FR | |
| currant bud absolute replacer | FL/FR | |
| ginger white ginger | FR | |
| hollyberry | FR | |
| marjoram | FL/FR | |
| saffron | FR | |
| wormwood oil replacer | FR |
Occurrence (nature, food, other): note
| pepper black pepper Search Trop Picture | |
| pepper black pepper fruit Search Trop Picture | |
| tarragon Search Trop Picture | |
| yarrow Search Trop Picture |
Synonyms:
| N-iso | butyl (E,E)-2,4-decadienamide |
| (2E,4E)-N-iso | butyl Decadienamide |
| iso | butyl trans,trans-2,4-decadienamide |
| (E,E)-N-iso | butyl-2,4-decadienamide |
| E,E-N-iso | butyl-2,4-decadienamide |
| (2E,4E)-N-iso | butyldeca-2,4-dienamide |
| N-iso | butyldeca-trans-2-trans-4-dienamide |
| 2,4- | decadienamide, N-(2-methylpropyl)-, (2E,4E)- |
| 2,4- | decadienamide, N-(2-methylpropyl)-, (E,E)- |
| 2,4- | decadienamide, N-isobutyl-, (E,E)- |
| (E,E)-N-(2- | methyl propyl)-2,4-decadienamide |
| (E,E)-N-(2- | methylpropyl)-2,4-decadienamide |
| (2E,4E)-N-(2- | methylpropyl)deca-2,4-dienamide |
| (E)- | pellitorin |
| trans- | pellitorin |
| (E)- | pellitorine |
| trans- | pellitorine |