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ethyl 2,2-dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylate
Notes:
None found
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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): 97-41-6 Ethyl chrysanthemate >95.0%(GC)
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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): 05-24850 ETHYL CHRYSANTHEMATE
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Sigma-Aldrich Complete Supply Chain The perfect blend of products and services that bring your creativity to life. Sigma-Aldrich is a leading Life Science and High Technology company dedicated to providing high-quality, safe and certified flavor ingredients with transparent and easily accessible documentation to customers around the globe. Sigma-Aldrich also provides a suite of analytical tools that allow food analysts to simplify sample preparation, cleanup and analysis steps, while increasing sensitivity to trace ingredients and harmful substances to meet regulations and quality standards. Email: Information US Email: Sales US Voice: 800-244-1173 US Fax: 800-368-4661 Facebook Twitter Instagram Linkedin Flavors and Fragrances Analysis FandF Newsletter Subscription Flavors and Fragrances Learning Center Certified Food Grade Products Product(s): W506109 Ethyl chrysanthemate, mixture of cis and trans, ≥95% SDS
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TCI AMERICA Moving Your Chemistry Forward We continuously strive to advance our technology. With East & West Coast distribution centers, count on TCI to deliver products quickly and reliably. Over 30,000 Reagents available today in benchtop to bulk quantities. We also offer custom synthesis solutions. Sign up for a TCI account today for fast and free shipping! Tokyo Chemical Industry Co., Ltd. (TCI) is a leading worldwide manufacturer of specialty organic chemicals founded in 1946. TCI provides organic laboratory chemicals as well as pharmaceutical, cosmetic and functional materials. More than 70 years of synthesis experience and multi-purpose plants enable TCI to offer more than 30,000 products as well as custom synthesis. US Email: Sales Email: Technical Support Voice: 1-800-423-8616 Fax: 1- 888-520-1075 Facebook Twitter Instagram Linkedin Product(s): D2112 Ethyl 2,2-Dimethyl-3-(2-methyl-1-propenyl)cyclopropane-1-carboxylate >95.0%(GC)
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| CAS Number: | 97-41-6 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 202-579-7 | |
| Nikkaji Web: | J23.507E | |
| Beilstein Number: | 2045740 | |
| MDL: | MFCD00001304 | |
| XlogP3: | 4.10 (est) | |
| Molecular Weight: | 196.28980000 | |
| Formula: | C12 H20 O2 | |
| BioActivity Summary: | listing | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
| CAS Number: | 15543-65-4 |  3D/inchi
|
| Nikkaji Web: | J1.242.288A | |
| XlogP3: | 4.10 (est) | |
| Molecular Weight: | 196.28980000 | |
| Formula: | C12 H20 O2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
| CAS Number: | 97-41-6 (RS) |  3D/inchi
|
| Nikkaji Web: | J1.532.548H | |
| XlogP3: | 4.10 (est) | |
| Molecular Weight: | 196.28980000 | |
| Formula: | C12 H20 O2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
| CAS Number: | 97-41-6 (SR) |  3D/inchi
|
| Nikkaji Web: | J1.533.114C | |
| XlogP3: | 4.10 (est) | |
| Molecular Weight: | 196.28980000 | |
| Formula: | C12 H20 O2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
| CAS Number: | 97-41-6 (SS) |  3D/inchi
|
| Nikkaji Web: | J441.668F | |
| XlogP3: | 4.10 (est) | |
| Molecular Weight: | 196.28980000 | |
| Formula: | C12 H20 O2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: 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 |
Physical Properties:
| Appearance: | colorless to yellow clear liquid (est) |
| Assay: | 95.00 to 100.00 % sum of isomers |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.92000 to 0.92600 @ 20.00 °C. |
| Pounds per Gallon - (est).: | 7.664 to 7.714 |
| Refractive Index: | 1.45800 to 1.46200 @ 20.00 °C. |
| Boiling Point: | 112.00 °C. @ 10.00 mm Hg |
| Vapor Pressure: | 0.037000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 184.00 °F. TCC ( 84.44 °C. ) |
| logP (o/w): | 4.181 (est) |
| Soluble in: | |
| alcohol | |
| water, 10.44 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Type: herbal | |
| herbal winey fruity immortelle floral chrysanthemum sweet | |
| Odor Description: at 10.00 % in dipropylene glycol. | herbal wine fruity everlasting flower chrysanthemum sweet |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| BOC Sciences |
| For experimental / research use only. |
| Ethyl chrysanthemate >95.0%(GC) |
| Frinton Laboratories |
| For experimental / research use only. |
| Ethyl 2,2-Dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylate |
| Penta International |
| ETHYL CHRYSANTHEMATE |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| Ethyl Chrysanthemate |
| Sigma-Aldrich |
| Ethyl chrysanthemate, mixture of cis and trans, ≥95%
Odor: herbaceous; wine-like; ethereal; sweet |
| Certified Food Grade Products |
| TCI AMERICA |
| For experimental / research use only. |
| Ethyl 2,2-Dimethyl-3-(2-methyl-1-propenyl)cyclopropane-1-carboxylate >95.0%(GC) |
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: | |
|
oral-rat LD50 2600 mg/kg Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(1), Pg. 16, 1986. oral-mouse LD50 2600 mg/kg Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(1), Pg. 16, 1986. oral-guinea pig LD50 1900 mg/kg Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(1), Pg. 16, 1986. | |
| Dermal Toxicity: | |
|
skin-mouse LD50 > 5000 mg/kg Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(1), Pg. 16, 1986. | |
| Inhalation Toxicity: | |
|
inhalation-mammal (species unspecified) LC50 > 1600 mg/m3 Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 31(7), Pg. 53, 1987. inhalation-mouse LC > 1600 mg/m3 Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 31(7), Pg. 53, 1987. inhalation-mammal (species unspecified) LC50 > 1600 mg/m3 BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: EXCITEMENT Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(1), Pg. 16, 1986. | |
Safety in Use Information:
| Category: | 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 ethyl chrysanthemate usage levels up to: | |||
| 0.3000 % in the fragrance concentrate. | |||
| Recommendation for ethyl chrysanthemate flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| Chemical Carcinogenesis Research Information System: | Search |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA GENetic TOXicology: | Search |
| EPA Substance Registry Services (TSCA): | 97-41-6 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 7334 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 2 |
| ethyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | |
| Chemidplus: | 0000097416 |
| RTECS: | GZ1727000 for cas# 97-41-6 |
| ethyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | |
| Chemidplus: | 015543654 |
| ethyl (1R,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | |
| ethyl (1S,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | |
| ethyl (1S,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate |
References:
| ethyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 97-41-6 |
| Pubchem (cid): | 7334 |
| Pubchem (sid): | 150393 |
| Pherobase: | View |
| ethyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 15543-65-4 |
| Pubchem (cid): | 177610 |
| Pubchem (sid): | 754829 |
| ethyl (1R,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 97-41-6 |
| Pubchem (cid): | 719276 |
| Pubchem (sid): | 35396592 |
| ethyl (1S,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 97-41-6 |
| Pubchem (cid): | 719271 |
| Pubchem (sid): | 35396588 |
| ethyl (1S,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 97-41-6 |
| Pubchem (cid): | 719273 |
| Pubchem (sid): | 35396590 |
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 |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2916.20.5000 |
| ChemSpider: | View |
Potential Blenders and core components note
Potential Uses:
| chrysanthemum | FR | |
| fruit | FR | |
| herbal | FR | |
| immortelle | FL/FR | |
| incense | FR | |
| marigold | FL/FR |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| chrysanthemic acid ethyl ester | |
| chrysanthemic acid, ethyl ester | |
| chrysanthemum monocarboxylic acid ethyl ester | |
| cyclopropanecarboxylic acid, 2, 2-dimethyl-3- (2-methyl-1-propenyl)-, ethyl ester | |
| cyclopropanecarboxylic acid, 2,2-dimethyl-3- (2-methylpropenyl)-, ethyl ester | |
| cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, ethyl ester | |
| cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, ethyl ester | |
| cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-,ethyl ester | |
| cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-, ethyl ester | |
| 2,2- | dimethyl-3-(1-isobutenyl)cyclopropane-1-carboxylic acid ethyl ester |
| 2,2- | dimethyl-3-(2-methyl propenyl) cyclopropane carboxylic acid ethyl ester |
| 2,2- | dimethyl-3-(2-methyl-1-propenyl)cyclopropane carboxylic acid ethyl ester |
| 2,2- | dimethyl-3-(2-methylpropenyl)cyclopropanecarboxylic acid ethyl ester |
| ethyl 2,2-dimethyl-3-(2-methyl prop-1-enyl) cyclopropane-1-carboxylate | |
| (E+Z)- | ethyl 2,2-dimethyl-3-(2-methyl propenyl) cyclopropane carboxylate |
| ethyl 2,2-dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylate | |
| ethyl 2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate | |
| ethyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | |
| ethyl chrysanthemumate | |
| (E+Z)- | ethyl chrysanthemumate |