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1R,2S,5R-isopulegol acetate
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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): 57576-09-7 isoPulegyl Acetate
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M&U International LLC Steady supply & demand Meeting customers increasing demands at home as well as abroad. M&U dedicates itself to the development and production of new products as well as continuously promoting those new products. We’ve maintained a steady supply&demand relationship with a large number of manufacturers at home and abroad. We’ve developed an extensive network and because of our relationships with these manufacturers, we’re able to provide a stable supply of great quality materials. We’re located in China’s largest communications hub, Shanghai and in the U.S. near one of the largest sea ports on the East Coast. The strategic locations of our facilities ensure convenient, prompt and secure delivery of our products to our customers. Email: Sales US Email: Sales Voice: +86-21-32515501 60762991 60762992 Fax: +86-21-32515502 64204960 US Voice: 908-359-9000 US Fax: 908-359-9002 News Product(s): A0690 Isopulegol Acetate
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OQEMA With a focus on providing the highest level of service OQEMA has established itself at the forefront of the global chemical industry. The guiding principles of OQEMA have always been to establish long term relationships with customers and suppliers alike to build sustainable and profitable business for all parties. Through OQEMA’s business divisions the company tailors products and services to better support and service our customers requirements. This structure also allows the company to focus its marketing campaigns more effectively to certain industries. Over the last decade OQEMA has achieved strong growth as a result of the expansion of our business model. Going forward, the company will be expanding this business model into existing and new strategic territories. Email: Contact Us: US Email: Dean Matienzo Email: Sales US Email: Dean Matienzo - Sales Manager Voice: +44 1993 843081 Fax: +44 1993 841261 US Voice: +1 973 886 3778 US Fax: +1 973 346 1106 Linkedin Website Global Distribution Product(s): isoPulegyl Acetate
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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): 09-61000 ISOPULEGOL ACETATE 09-61001 ISOPULEGOL ACETATE NATURAL
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Vigon International Passion for Simplicity Manufacturer and supplier of high quality flavor and fragrance ingredients. The growth and success of Vigon is due in large part to a unique corporate concept that Vigon has developed and established within the industry: Creative Partnerships. This partnership concept has been and continues to be the foundation and guiding principle for all of Vigon's activities. US Email: Sales US Voice: 570-476-6300 US Fax: 570-476-1110 Facebook Twitter Linkedin Newsletter Blog Products List: View Product(s): 500955 Isopulegol Acetate
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| CAS Number: | 57576-09-7 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 260-820-1 | |
| FDA UNII: | R3C4VQ5WQM | |
| Nikkaji Web: | J22.835D | |
| CoE Number: | 2067 | |
| XlogP3-AA: | 3.50 (est) | |
| Molecular Weight: | 196.28980000 | |
| Formula: | C12 H20 O2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
| CAS Number: | 57576-09-7 (RSR) |  3D/inchi
|
| XlogP3-AA: | 3.50 (est) | |
| Molecular Weight: | 196.28980000 | |
| Formula: | C12 H20 O2 | |
| BioActivity Summary: | listing | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
| EFSA/JECFA Comments: | Register name to be change to 1R,2S,5R-isopulegyl acetate. According to the JECFA: Min. assay value is "95 % (total of isomers)". Composition of mixture not specified. | |
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: | 756 isopulegyl acetate |
| DG SANTE Food Flavourings: | 09.219 1R,2S,5R-isopulegol acetate |
| FEMA Number: | 2965 isopulegyl acetate |
| FDA: | No longer provide for the use of these seven synthetic flavoring substances |
Physical Properties:
| Appearance: | colorless clear liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.92900 to 0.93600 @ 25.00 °C. |
| Pounds per Gallon - (est).: | 7.730 to 7.788 |
| Refractive Index: | 1.45400 to 1.45700 @ 20.00 °C. |
| Melting Point: | 85.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 104.00 to 105.00 °C. @ 10.00 mm Hg |
| Boiling Point: | 112.00 to 114.00 °C. @ 8.00 mm Hg |
| Acid Value: | 1.00 max. KOH/g |
| Vapor Pressure: | 0.025000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 186.00 °F. TCC ( 85.56 °C. ) |
| logP (o/w): | 4.246 (est) |
| Soluble in: | |
| alcohol | |
| water, slightly | |
| water, 8.307 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Type: mentholic | |
| Odor Strength: | medium |
| Substantivity: | 24 hour(s) at 100.00 % |
| woody sweet peppermint tropical | |
| Odor Description: at 100.00 %. | woody sweet peppermint tropical Luebke, William tgsc, (1985) |
| woody sweet camphoreous cooling medicinal seedy berry | |
| Odor Description: | Woody, sweet, camphoreous, cooling and medicinal with a seedy berry undernote Mosciano, Gerard P&F 19, No. 6, 53, (1994) |
| Flavor Type: woody | |
| woody berry green camphoreous fruity | |
| Taste Description: at 10.00 ppm. | Woody, berry, green and camphoreous with a fruity nuance Mosciano, Gerard P&F 19, No. 6, 53, (1994) |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
perfuming agents |
Suppliers:
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. | |
| Human Experience: | |
| 8 % solution: no irritation or sensitization. | |
| 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 isopulegyl acetate usage levels up to: | |||
| 8.0000 % in the fragrance concentrate. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 0.12 (μg/capita/day) | ||
| Maximised Survey-derived Daily Intakes (MSDI-USA): | 1.10 (μg/capita/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: 3 | |||
| Click here to view publication 3 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | - | 19.00000 | |
| beverages(nonalcoholic): | - | 5.80000 | |
| beverages(alcoholic): | - | - | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | - | - | |
| condiments / relishes: | - | - | |
| confectionery froastings: | - | - | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | 22.00000 | |
| fruit ices: | - | 22.00000 | |
| gelatins / puddings: | - | - | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | - | 19.00000 | |
| 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: | - | - | |
Safety References:
| Flavor & Extract Manufacturers Association (FEMA) reference(s): | |
| The FEMA GRAS assessment of alicyclic substances used as flavor ingredients. View pdf | |
| 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 57 (FGE.57)[1]: Consideration of two structurally related pulegone metabolites and one ester thereof evaluated by JECFA (55th 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 57, Revision 1 (FGE.57Rev1): consideration of isopulegone and three flavouring substances evaluated by JECFA (55th meeting) View page or View pdf | |
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 57576-09-7 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 494311 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 2 |
| (5-methyl-2-prop-1-en-2-ylcyclohexyl) acetate | |
| Chemidplus: | 0057576097 |
| [(1R,2S,5R)-5-methyl-2-prop-1-en-2-ylcyclohexyl] acetate | |
References:
| (5-methyl-2-prop-1-en-2-ylcyclohexyl) acetate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 57576-09-7 |
| Pubchem (cid): | 494311 |
| Pubchem (sid): | 135264106 |
| Pherobase: | View |
| [(1R,2S,5R)-5-methyl-2-prop-1-en-2-ylcyclohexyl] acetate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 57576-09-7 |
| Pubchem (cid): | 94579 |
| Pubchem (sid): | 671690 |
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 |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2915.39.9050 |
| Typical G.C. | |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
Potential Uses:
| berry | FR | |
| green | FR | |
| lavender | FR | |
| mint | FR | |
| peppermint | FR | |
| raspberry | FR | |
| rose | FR | |
| spearmint | FR |
Occurrence (nature, food, other): note
| mayur pankh fruit oil himalaya @ 0.10% Data GC Search Trop Picture | |
| pennyroyal Search Trop Picture | |
| wormseed oil spain @ 0.08% Data GC Search Trop Picture |
Synonyms:
| p- | menth-8-en-3-yl acetate |
| para- | menth-8-en-3-yl acetate |
| (1R,2S,5R)-5- | methyl-2-(1-methyl ethenyl) cyclohexanol acetate |
| (1theta- (1alpha,2beta,5alpha))-5- | methyl-2-(1-methyl ethenyl) cyclohexanol acetate |
| (1R,2S,5R)-5- | methyl-2-(1-methylethenyl)cyclohexanol acetate |
| (1theta- (1alpha,2beta,5alpha))-5- | methyl-2-(1-methylethenyl)cyclohexanol acetate |
| 5- | methyl-2-(1-methylvinyl)cyclohexyl acetate |
| (1R,2R,5R)-5- | methyl-2-prop-1-en-2-yl cyclohexyl acetate |
| (1R,2R,5R)-5- | methyl-2-prop-1-en-2-ylcyclohexyl acetate |
| (5- | methyl-2-prop-1-en-2-ylcyclohexyl) acetate |
| 1- | methyl-4-isopropenyl cyclohexan-3-yl acetate |
| 1- | methyl-4-isopropenylcyclohexan-3-yl acetate |
| 2-iso | propenyl-5-methylcyclohexyl acetate |
| 1R,2S,5R-iso | pulegol acetate |
| iso | pulegol acetate |
| iso | pulegyl acetate natural |