Articles:
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1-(3,4-methylenedioxyphenyl)propane
Notes:
None found
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Fleurchem, Inc. Have A Flavorful Day A leading global manufacturer and supplier of ingredients for Flavors, Fragrances, AromaTherapy, Foods, Beverages, Personal Care Products, and other uses. Operating out of the 200,000 sq. ft., former Hercules/PFW facility in Middletown, NY; Fleurchem produces a full range of natural isolates, synthetic chemicals & specialities, essential oils and flavors. Additionally, the company performs toll manufacturing, as well as custom chemical synthesis for a wide range of clients. Email: Information US Voice: 845-341-2100 US Fax: 845-341-2121 Product(s): dihydrosafrole
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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): 04-21000 DIHYDROSAFROLE
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| CAS Number: | 94-58-6 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 202-344-9 | |
| FDA UNII: | 2ML63PLH7G | |
| Nikkaji Web: | J15.552G | |
| Beilstein Number: | 0131188 | |
| MDL: | MFCD00022999 | |
| XlogP3: | 3.20 (est) | |
| Molecular Weight: | 164.20404000 | |
| Formula: | C10 H12 O2 | |
| BioActivity Summary: | listing | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: information only not used for fragrances or flavors
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 |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
Physical Properties:
| Appearance: | colorless to pale yellow clear liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 1.06300 to 1.07000 @ 25.00 °C. |
| Pounds per Gallon - (est).: | 8.845 to 8.903 |
| Refractive Index: | 1.51700 to 1.52000 @ 20.00 °C. |
| Boiling Point: | 112.00 °C. @ 15.00 mm Hg |
| Boiling Point: | 225.52 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.056000 mmHg (est) |
| Flash Point: | 211.00 °F. TCC ( 99.30 °C. ) (est) |
| logP (o/w): | 3.587 (est) |
| Soluble in: | |
| alcohol | |
| water, 56.87 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Type: spicy | |
| spicy sassafrass | |
| Odor Description: at 10.00 % in dipropylene glycol. | spicy sassafras |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| Carbosynth |
| For experimental / research use only. |
| Dihydrosafrole |
| Fleurchem |
| dihydrosafrole |
| Penta International |
| DIHYDROSAFROLE |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| Dihydrosafrole |
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. | |
| Human Experience: | |
| 12 % solution: no irritation or sensitization. | |
| Oral/Parenteral Toxicity: | |
|
oral-rat LD50 2260 mg/kg Toxicology and Applied Pharmacology. Vol. 7, Pg. 18, 1965. oral-mouse LD50 3700 mg/kg Toxicology and Applied Pharmacology. Vol. 7, Pg. 18, 1965. intraperitoneal-mouse LD50 2830 mg/kg Comptes Rendus Hebdomadaires des Seances, Academie des Sciences. Vol. 250, Pg. 1148, 1960. | |
| Dermal Toxicity: | |
|
skin-rabbit LD50 > 5000 mg/kg Food and Cosmetics Toxicology. Vol. 12, Pg. 527, 1974. | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | information only not used for fragrances or flavors | ||
| IFRA Critical Effect: | Carcinogenicity | ||
| IFRA fragrance material specification: | |||
| Safrole as such should not be used as a fragrance ingredient; essential oils containing safrole should not be used at a level such that the total concentration of safrole exceeds 0.01% in consumer products. Examples of essential oils with a high safrole content are Sassafras oil (Sassafras officinale Nees& Eberm.), Ocotea Cymbarum oil (Ocotea pretiosa Metz) and certain qualities of Camphor oils. The total concentration of safrole, isosafrole and dihydrosafrole should not exceed 0.01% in consumer products. These recommendations are based on the conclusions of the Scientific Committee on Cosmetology of the EEC on safrole and on the similarity of the biological activity of these substances (Scientific Committee of Cosmetology of the EEC, opinion reached on September 2, 1980; Communication to the EEC Commission ENV/521/79 and IARC Monograph Vol. 10, 1976, 231-244). | |||
| IFRA: | View Standard | ||
| View IFRA Standards Library for complete information. | |||
| Please review Amendment 49 IFRA documentation for complete information. | |||
| IFRA RESTRICTION LIMITS IN THE FINISHED PRODUCT (%): | |||
| Category 1: Products applied to the lips | |||
| See notebox % | |||
| Category 2: Products applied to the axillae | |||
| See notebox % | |||
| Category 3: Products applied to the face/body using fingertips | |||
| See notebox % | |||
| Category 4: Products related to fine fragrance | |||
| See notebox % | |||
| Category 5: Products applied to the face and body using the hands (palms), primarily leave-on | |||
| Category 5A: Body lotion products applied to the body using the hands (palms), primarily leave-on | |||
| See notebox % | |||
| Category 5B: Face moisturizer products applied to the face using the hands (palms), primarily leave-on | |||
| See notebox % | |||
| Category 5C: Hand cream products applied to the hands using the hands (palms), primarily leave-on | |||
| See notebox % | |||
| Category 5D: Baby Creams, baby Oils and baby talc | |||
| See notebox % | |||
| Category 6: Products with oral and lip exposure | |||
| See notebox % | |||
| Category 7: Products applied to the hair with some hand contact | |||
| Category 7A: Rinse-off products applied to the hair with some hand contact | |||
| See notebox % | |||
| Category 7B: Leave-on products applied to the hair with some hand contact | |||
| See notebox % | |||
| Category 8: Products with significant anogenital exposure | |||
| See notebox % | |||
| Category 9: Products with body and hand exposure, primarily rinse off | |||
| See notebox % | |||
| Category 10: Household care products with mostly hand contact | |||
| Category 10A: Household care excluding aerosol products (excluding aerosol/spray products) | |||
| See notebox % | |||
| Category 10B: Household aerosol/spray products | |||
| See notebox % | |||
| Category 11: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate | |||
| Category 11A: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure | |||
| See notebox % | |||
| Category 11B: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure | |||
| See notebox % | |||
| Category 12: Products not intended for direct skin contact, minimal or insignificant transfer to skin | |||
| See notebox | |||
| Notes: | |||
| IFRA FLAVOR REQUIREMENTS: | |||
Due to the possible ingestion of small amounts of fragrance ingredients from their use in products in Categories 1 and 6, materials must not only comply with IFRA Standards but must also be recognized as safe as a flavoring ingredient as defined by the IOFI Code of Practice (www.iofi.org). For more details see chapter 1 of the Guidance for the use of IFRA Standards. | |||
| Fragrance ingredient restriction - Note box | |||
| On the basis of established maximum concentration levels of this substance in commercially available natural sources (like essential oils, extracts and absolutes), exposure to this substance from the use of these oils and extracts is regarded acceptable as long as the total concentration of Safrole, Isosafrole and Dihydrosafrole in the finished consumer pro duct doesnot exceed 0.01%. | |||
| Recommendation for dihydrosafrole 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 |
| Carcinogenic Potency Database: | Search |
| EPA GENetic TOXicology: | Search |
| EPA Substance Registry Services (TSCA): | 94-58-6 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 7197 |
| National Institute of Allergy and Infectious Diseases: | Data |
| 5-propyl-1,3-benzodioxole | |
| Chemidplus: | 0000094586 |
| EPA/NOAA CAMEO: | hazardous materials |
References:
| 5-propyl-1,3-benzodioxole | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 94-58-6 |
| Pubchem (cid): | 7197 |
| Pubchem (sid): | 134971291 |
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 |
| CHEBI: | View |
| KEGG (GenomeNet): | C19229 |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2932.99.6550 |
| ChemSpider: | View |
| Wikipedia: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| benzene, 1,2-(methylenedioxy)-4-propyl- | |
| benzene, 1,2-methylenedioxy-4-propyl- | |
| 1,3- | benzodioxole, 5-propyl- |
| dihydrosafrol | |
| 2',3'- | dihydrosafrole |
| 1,2- | methylenedioxy-4-propyl benzene |
| [1,2-( | methylenedioxy)-4-propyl]benzene |
| 1,2-( | methylenedioxy)-4-propylbenzene |
| 1-(3,4- | methylenedioxyphenyl)propane |
| 4- | propyl-1,2-(methylenedioxy)benzene |
| 4- | propyl-1,2-methylenedioxybenzene |
| 5- | propyl-1,3-benzodioxole |
| safrole, dihydro- |