| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 72437-64-0 |
| FDA UNII: | SO4Z6HE5LA |
| Category: | flavoring agents |
| IUPAC Name: | butyl propyl disulfide |
| InChI : | InChI=1/C7H16S2/c1-3-5-7-9-8-6-4-2/h3-7H2,1-2H3 |
| Std.InChI: | InChI=1S/C7H16S2/c1-3-5-7-9-8-6-4-2/h3-7H2,1-2H3 |
| InChIKey : | VITWKRWSBFUVDT-UHFFFAOYAZ |
| Std.InChIKey: | VITWKRWSBFUVDT-UHFFFAOYSA-N |
| SMILES : | CCCCSSCCC |
| Molar Refractivity : | 50.47 ± 0.3 cm3 (est) |
| Parachor : | 411.9 ± 4.0 cm3 (est) |
| Index of Refraction : | 1.498 ± 0.02 (est) |
| Surface Tension : | 32.8 ± 3.0 dyne/cm (est) |
| Density : | 0.955 ± 0.06 g/cm3 (est) |
| Polarizability : | 20.00 ± 0.5 10-24cm3 (est) |
| 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: | 1932 butyl propyl disulfide |
| FEMA Number: | 4577 mixture ofbutyl propyl disulfide and propyl and butyl disulfide |
| FDA: | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF): | 977187-86-2 ; MIXTURE OF BUTYL PROPYL DISULFIDE AND PROPYL AND BUTYL DISULFIDE |
| Appearance: | colorless to pale yellow clear liquid (est) |
| Assay: | 51.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.94500 to 0.95500 @ 20.00 °C. |
| Pounds per Gallon - (est).: | 7.873 to 7.956 |
| Refractive Index: | 1.49000 to 1.50000 @ 20.00 °C. |
| Boiling Point: | 208.00 to 210.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 89.00 to 90.00 °C. @ 10.00 mm Hg |
| Vapor Pressure: | 0.259000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 174.00 °F. TCC ( 78.89 °C. ) |
| logP (o/w): | 4.697 (est) |
| Soluble in: | |
| alcohol | |
| water, 13.14 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
| None found |
| Aston Chemical |
| For experimental / research use only. |
| Disulfide, butyl propyl |
| Axsyn |
| For experimental / research use only. |
| Disulfide, butyl propyl |
| Chemical Sources Association |
| Need This Item for Flavor/Food?: You can contact the Chemical Sources Association |
| 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 | |
| Category: | |||
| flavoring agents | |||
| Recommendation for butyl propyl disulfide usage levels up to: | |||
| not for fragrance use. | |||
| 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: 24 | |||
| Click here to view publication 24 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | - | - | |
| beverages(nonalcoholic): | - | - | |
| beverages(alcoholic): | - | - | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | - | - | |
| condiments / relishes: | - | - | |
| confectionery froastings: | - | - | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | - | |
| fruit ices: | - | - | |
| gelatins / puddings: | - | - | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | - | - | |
| imitation dairy: | - | - | |
| instant coffee / tea: | - | - | |
| jams / jellies: | 0.00100 | 0.01000 | |
| meat products: | - | - | |
| milk products: | - | - | |
| nut products: | - | - | |
| other grains: | - | - | |
| poultry: | - | - | |
| processed fruits: | - | - | |
| processed vegetables: | - | - | |
| reconstituted vegetables: | - | - | |
| seasonings / flavors: | - | - | |
| snack foods: | 0.00100 | 0.01000 | |
| soft candy: | - | - | |
| soups: | 0.00100 | 0.01000 | |
| sugar substitutes: | - | - | |
| sweet sauces: | - | - | |
| 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 :522458 |
| National Institute of Allergy and Infectious Diseases:Data |
| 1-propyldisulfanylbutane |
| Chemidplus:0072437640 |
| 1-propyldisulfanylbutane | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 522458 |
| Pubchem (sid): | 126505071 |
| Pherobase: | View |
| (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): | HMDB33051 |
| FooDB: | FDB011044 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| FAO: | Butyl propyl disulfide |
| None Found |
| None Found |
| mixture of | butyl propyl disulfide and propyl and butyl disulfide |
| disulfide, butyl propyl | |
| propyl butyl disulfide | |
| propyl N-butyl disulfide | |
| N- | propyl N-butyl disulphide |
| 1-( | propyldisulfanyl)butane |
| 1- | propyldisulfanylbutane |
| None found yet. Try the PubMed Search. |
