sec-amyl mercaptan
2-pentanethiol

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  Endeavour Specialty Chemicals Ltd

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  Robinson Brothers Limited

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  R C Treatt and Co Ltd

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  2-Pentanethiol

Name: pentane-2-thiol CAS Number: 2084-19-7 3D/inchi ECHA EINECS - REACH Pre-Reg: 218-224-4 FDA UNII: 529XY6M4QX Nikkaji Web: J121.680E MDL: MFCD00053516 XlogP3-AA: 2.20 (est) Molecular Weight: 104.21564000 Formula: C5 H12 S 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: 514 2-pentanethiol DG SANTE Food Flavourings: 12.192 pentane-2-thiol FEMA Number: 3792 2-pentanethiol FDA: No longer provide for the use of these seven synthetic flavoring substances FDA Mainterm (SATF): 2084-19-7 ; 2-PENTANETHIOL   Physical Properties: Appearance: colorless clear liquid (est) Assay: 97.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.83200 @ 20.00 °C. Refractive Index: 1.44200 to 1.45200 @ 20.00 °C. Melting Point: -169.00 °C. @ 760.00 mm Hg Boiling Point: 112.00 to 114.00 °C. @ 760.00 mm Hg Vapor Pressure: 23.239000 mmHg @ 25.00 °C. (est) Flash Point: 80.00 °F. TCC ( 26.67 °C. ) logP (o/w): 2.814 (est) Soluble in:   alcohol   water, 599.2 mg/L @ 25 °C (est) Insoluble in:   water Similar Items:note allyl mercaptan amyl mercaptan isoamyl mercaptan tert-amyl mercaptan benzyl mercaptan buchu mercaptan butyl mercaptan isobutyl mercaptan tert-butyl mercaptan cetyl mercaptan cyclohexyl mercaptan cyclopentyl mercaptan decyl mercaptan dodecyl mercaptan 2-ethyl hexyl mercaptan ethyl mercaptan ethylene mercaptan furfuryl mercaptan grapefruit mercaptan heptyl mercaptan hexyl mercaptan methyl mercaptan 2-naphthyl mercaptan nonyl mercaptan octyl mercaptan peach mercaptan 1-phenethyl mercaptan 2-phenethyl mercaptan phenyl mercaptan prenyl mercaptan propyl mercaptan isopropyl mercaptan 2-thienyl mercaptan 3-thienyl mercaptan tridecyl mercaptan undecyl mercaptan   Organoleptic Properties: Odor Description:at 0.10 % in propylene glycol. sulfury gassy Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: BOC Sciences For experimental / research use only. 2-Pentanethiol DeLong Chemicals America 2-Pentanethiol Endeavour Specialty Chemicals 2-Pentanethiol 10% in Triacetin Speciality Chemical Product Groups Endeavour Specialty Chemicals 2-Pentanethiol 98% F&F M&U International 2-MERCAPTO PENTANE, Kosher Penta International 2-PENTANETHIOL Pfaltz & Bauer For experimental / research use only. sec-Amyl mercaptan 98% sds R C Treatt & Co Ltd 2-Pentanethiol 10% in Triacetin Kosher R C Treatt & Co Ltd 2-Pentanethiol Halal, Kosher Robinson Brothers 2-Pentanethiol 10% in Triacetin https://www.robinsonbrothers.uk/chemistry-competences Robinson Brothers 2-Pentanethiol F&F Synerzine 2-Pentanethiol Tengzhou Jitian Aroma Chemiclal 2-Mercapto pentane WholeChem 2-Pentanethiol   Safety Information: Preferred SDS: View European information : Most important hazard(s): Xi - Irritant R 10 - Flammable. R 36/37/38 - Irritating to eyes, respiratory system, and skin. S 02 - Keep out of the reach of children. S 16 - Keep away from sources of ignition - No Smoking. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36/37/39 - Wear suitable clothing, gloves and eye/face protection.   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: gavage-rat LD50 [sex: M,F] > 5000 mg/kg (Collinson, 1989a) Dermal Toxicity: Not determined Inhalation Toxicity: Not determined   Safety in Use Information: Category: flavoring agents Recommendation for sec-amyl mercaptan usage levels up to:   not for fragrance use.   Maximised Survey-derived Daily Intakes (MSDI-EU): 1.50 (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: 16 Click here to view publication 16   average usual ppm average maximum ppm baked goods: 0.06000 0.10000 beverages(nonalcoholic): 0.02000 0.04000 beverages(alcoholic): 0.01000 0.03000 breakfast cereal: 0.02000 0.05000 cheese: 0.00100 0.01000 chewing gum: 0.01000 0.10000 condiments / relishes: 0.02000 0.10000 confectionery froastings: 0.02000 0.10000 egg products: - - fats / oils: 0.00500 0.02000 fish products: - - frozen dairy: 0.02000 0.06000 fruit ices: 0.02000 0.04000 gelatins / puddings: 0.01000 0.05000 granulated sugar: - - gravies: 0.00500 0.05000 hard candy: 0.03000 0.10000 imitation dairy: 0.02000 0.06000 instant coffee / tea: 0.00500 0.05000 jams / jellies: 0.00500 0.05000 meat products: 0.00500 0.05000 milk products: 0.00100 0.01000 nut products: - - other grains: - - poultry: - - processed fruits: - - processed vegetables: - - reconstituted vegetables: - - seasonings / flavors: - - snack foods: 0.01000 0.05000 soft candy: 0.05000 0.10000 soups: 0.00100 0.01000 sugar substitutes: - - sweet sauces: 0.01000 0.05000   Safety References: 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 8 (FGE.08)[1]: Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical group 20 View page or View pdf Flavouring Group Evaluation 8, Revision 1 (FGE.08Rev1): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30 View page or View pdf Scientific Opinion on Flavouring Group Evaluation 8, Revision 3 (FGE.08Rev3): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30 View page or View pdf Scientific Opinion on Flavouring Group Evaluation 08, Revision 4 (FGE.08Rev4): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30 View page or View pdf 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 :62424 National Institute of Allergy and Infectious Diseases:Data WISER:UN 1111 WGK Germany:3 pentane-2-thiol Chemidplus:0002084197   References:   pentane-2-thiol NIST Chemistry WebBook: Search Inchi Pubchem (cid): 62424 Pubchem (sid): 135021137   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 HMDB (The Human Metabolome Database): Search FooDB: FDB020872 Export Tariff Code: 2930.90.9999 VCF-Online: VCF Volatile Compounds in Food ChemSpider: View FAO: 2-Pentanethiol   Potential Blenders and core components note For Odor fruity 2- methyl-2-pentenal FL/FR herbal (E)-2- dodecenal FL/FR For Flavor alliaceous allyl thiopropionate FL diethyl disulfide FL fruity 2- methyl-2-pentenal FL/FR waxy (E)-2- dodecenal FL/FR   Potential Uses: None Found   Occurrence (nature, food, other):note   coffee Search PMC Picture   guava fruit Search Trop Picture   Synonyms:   amyl mercaptan, sec- 2- mercapto pentane 2- mercaptopentane 1- methyl butane thiol 1- methyl butyl hydrosulfide 1- methyl butyl mercaptan 1- methylbutanethiol 1- methylbutyl hydrosulfide 1- methylbutyl mercaptan 2- pentane thiol   pentane-2-thiol 2- pentanethiol 2- pentanethiol 10% in triacetin 2- pentyl mercaptan   Articles:   None found yet. 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Notes: None found