ethyl isothiocyanate
isothiocyanatoethane

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  Product(s):
  542-85-8 Ethyl Isothiocyanate

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  05-43375 ETHYL ISOTHIOCYANATE

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  I0188 Ethyl Isothiocyanate >97.0%(GC)
  SDS

Name: isothiocyanatoethane CAS Number: 542-85-8 3D/inchi ECHA EINECS - REACH Pre-Reg: 208-831-2 FDA UNII: 3284MJ2T8P Nikkaji Web: J33.544D Beilstein Number: 1737705 MDL: MFCD00004820 XlogP3: 1.50 (est) Molecular Weight: 87.14485000 Formula: C3 H5 N S BioActivity Summary: listing NMR Predictor: Predict (works with chrome, Edge or firefox) Category:flavoring 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: 1885 ethyl isothiocyanate FEMA Number: 4420 ethyl isothiocyanate FDA: No longer provide for the use of these seven synthetic flavoring substances FDA Mainterm (SATF): 542-85-8 ; ETHYL ISOTHIOCYANATE   Physical Properties: Appearance: colorless clear liquid (est) Assay: 99.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.99700 to 1.00400 @ 25.00 °C. Pounds per Gallon - (est).: 8.296 to 8.354 Refractive Index: 1.51000 to 1.51500 @ 20.00 °C. Melting Point: -6.00 to -4.00 °C. @ 760.00 mm Hg Boiling Point: 130.00 to 132.00 °C. @ 760.00 mm Hg Vapor Pressure: 11.450000 mmHg @ 25.00 °C. (est) Flash Point: 89.00 °F. TCC ( 31.67 °C. ) logP (o/w): 1.470 Soluble in:   alcohol   water, 7022 mg/L @ 25 °C (est) Insoluble in:   water Similar Items:note allyl isothiocyanate amyl isothiocyanate isoamyl isothiocyanate benzyl isothiocyanate 3-buten-1-yl isothiocyanate butyl isothiocyanate isobutyl isothiocyanate sec-butyl isothiocyanate 5-hexen-1-yl isothiocyanate hexyl isothiocyanate methyl isothiocyanate 4-methyl thiobutyl isothiocyanate 6-methyl thiohexyl isothiocyanate 5-methyl thiopentyl isothiocyanate 4-pentenyl isothiocyanate 2-phenethyl isothiocyanate isopropyl isothiocyanate radish isothiocyanate   Organoleptic Properties: Odor Type: pungent pungent mustard garlic Odor Description:at 0.01 % in propylene glycol. pungent mustard garlic Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: BOC Sciences For experimental / research use only. Ethyl Isothiocyanate DeLong Chemicals America Ethyl isothiocyanate, Kosher EMD Millipore For experimental / research use only. Ethyl Isothiocyanate sds Penta International ETHYL ISOTHIOCYANATE Santa Cruz Biotechnology For experimental / research use only. Ethyl isothiocyanate Sigma-Aldrich: Aldrich For experimental / research use only. Ethyl Isothiocyanate 97% sds TCI AMERICA For experimental / research use only. Ethyl Isothiocyanate >97.0%(GC) sds   Safety Information: Preferred SDS: View European information : Most important hazard(s): T - Toxic. R 10 - Flammable. R 23/24/25 - Toxic by inhalation, in contact with skin and if swallowed. R 36/37/38 - Irritating to eyes, respiratory system, and skin. S 01/02 - Keep locked up and out of the reach of children. S 16 - Keep away from sources of ignition - No Smoking. S 33 - Take precautionary measures against static discharge. S 37 - Wear suitable gloves. S 45 - In case of accident or if you feel unwell seek medical advice immediately.   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: flavoring agents Recommendation for ethyl isothiocyanate 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: 23 Click here to view publication 23   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: 0.10000 0.50000 fish products: - - frozen dairy: - - fruit ices: - - gelatins / puddings: - - granulated sugar: - - gravies: - - hard candy: - - imitation dairy: - - instant coffee / tea: - - jams / jellies: - - meat products: 0.50000 5.00000 milk products: - - nut products: - - other grains: - - poultry: - - processed fruits: - - processed vegetables: - - reconstituted vegetables: - - seasonings / flavors: 0.20000 1.00000 snack foods: 0.10000 0.50000 soft candy: - - soups: 0.10000 0.50000 sugar substitutes: - - sweet sauces: - -   Safety References: EPI System: View Chemical Carcinogenesis Research Information System:Search AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):542-85-8 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :10966 National Institute of Allergy and Infectious Diseases:Data WISER:UN 3286 WGK Germany:3 isothiocyanatoethane Chemidplus:0000542858 RTECS:NX8590000 for cas# 542-85-8   References:   isothiocyanatoethane NIST Chemistry WebBook: Search Inchi Pubchem (cid): 10966 Pubchem (sid): 134976505   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): Search FooDB: FDB009395 Export Tariff Code: 2930.90.9190 VCF-Online: VCF Volatile Compounds in Food ChemSpider: View   Potential Blenders and core components note For Odor fruity furfuryl acetate FL/FR green (Z)-3- hexen-1-yl tiglate FL/FR 1- penten-3-ol FL/FR spicy ethyl vinyl ketone FL/FR sulfurous dimethyl sulfide FL/FR 2- methyl 5-(methyl thio) furan FL/FR 2- phenethyl isothiocyanate FL/FR For Flavor No flavor group found for these 4- methyl thiobutyl isothiocyanate FL 6- methyl thiohexyl isothiocyanate FL 5- methyl thiopentyl isothiocyanate FL 4- pentenyl isothiocyanate FL 2- phenethyl isothiocyanate FL/FR alliaceous alliaceous benzyl mercaptan FL cyclopentyl mercaptan FL 3- mercapto-2-pentanone FL 2- methyl thioacetaldehyde FL truffle sulfide FL burnt methyl phenyl disulfide FL estery furfuryl acetate FL/FR green 2- furyl acetone FL (Z)-3- hexen-1-yl tiglate FL/FR 1- penten-3-ol FL/FR musty 2- methyl 5-(methyl thio) furan FL/FR onion methyl propyl disulfide FL spicy ethyl vinyl ketone FL/FR sulfurous allyl sulfide FL dimethyl sulfide FL/FR furfuryl methyl sulfide FL vegetable radish isothiocyanate FL   Potential Uses: FL horseradish FL mustard FL radish FL wasabi   Occurrence (nature, food, other):note   horseradish root Search Trop Picture   mustard Search PMC Picture   Synonyms: 1,1'- dichlorodimethyl ether   ethane, isothiocyanato-   ethyl mustard oil   ethyl thioisocyanate   ethylisothiocyanate iso thiocyanato-ethane iso thiocyanatoethane iso thiocyanic acid ethyl ester iso thiocyanic acid, ethyl ester   Articles:   None found yet. 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Notes: None found