4-methyl-1-pentanol
1-pentanol, 4-methyl- (9CI)

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  A0329 4-METHYLPENTANOL, Kosher

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  4-methyl-1-pentanol

Name: 4-methylpentan-1-ol CAS Number: 626-89-1 3D/inchi ECHA EINECS - REACH Pre-Reg: 210-969-3 FDA UNII: X796XFP7D4 Nikkaji Web: J71.272H Beilstein Number: 1731303 MDL: MFCD00002962 CoE Number: 10278 XlogP3-AA: 1.60 (est) Molecular Weight: 102.17678000 Formula: C6 H14 O 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 DG SANTE Food Flavourings: 02.180 4-methylpentan-1-ol   Physical Properties: Appearance: colorless clear liquid (est) Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.82100 to 0.81600 @ 25.00 °C. Pounds per Gallon - (est).: 6.832 to 6.790 Refractive Index: 1.41100 to 1.41700 @ 20.00 °C. Boiling Point: 151.00 to 152.00 °C. @ 760.00 mm Hg Vapor Pressure: 1.366000 mmHg @ 25.00 °C. (est) Flash Point: 125.00 °F. TCC ( 51.67 °C. ) logP (o/w): 1.702 (est) Soluble in:   alcohol   water, 1.195e+004 mg/L @ 25 °C (est)   water, 7600 mg/L @ 25 °C (exp) Insoluble in:   water   Organoleptic Properties: Odor Description:nutty Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: BOC Sciences For experimental / research use only. 4-Methyl-1-pentanol M&U International 4-METHYLPENTANOL, Kosher Penta International 4-METHYL-1-PENTANOL Santa Cruz Biotechnology For experimental / research use only. 4-Methyl-1-pentanol ≥96% Sigma-Aldrich: Aldrich For experimental / research use only. 4-Methyl-1-pentanol 97% sds TCI AMERICA For experimental / research use only. 4-Methyl-1-pentanol >99.0%(GC) sds WholeChem 4-methyl-1-pentanol   Safety Information: Preferred SDS: View European information : Most important hazard(s): Xi - Irritant R 10 - Flammable. R 38 - Irritating to skin. S 02 - Keep out of the reach of children. S 16 - Keep away from sources of ignition - No Smoking. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 37/39 - Wear suitable 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: oral-rat LD50 6500 mg/kg (Wang & Bai, 1998) intravenous-mouse LD50 170 mg/kg Archives Internationales de Pharmacodynamie et de Therapie. Vol. 135, Pg. 330, 1962. Dermal Toxicity: Not determined Inhalation Toxicity: Not determined   Safety in Use Information: Category: flavoring agents Recommendation for 4-methyl-1-pentanol usage levels up to:   not for fragrance use.   Maximised Survey-derived Daily Intakes (MSDI-EU): 0.012 (μg/capita/day) Modified Theoretical Added Maximum Daily Intake (mTAMDI): 3900 (μg/person/day) Threshold of Concern: 1800 (μg/person/day) Structure Class: I   Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i). Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm.   average usage mg/kg maximum usage mg/kg Dairy products, excluding products of category 02.0 (01.0): 7.00000 35.00000 Fats and oils, and fat emulsions (type water-in-oil) (02.0): 5.00000 25.00000 Edible ices, including sherbet and sorbet (03.0): 10.00000 50.00000 Processed fruit (04.1): 7.00000 35.00000 Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): - - Confectionery (05.0): 10.00000 50.00000 Chewing gum (05.3): - - Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 5.00000 25.00000 Bakery wares (07.0): 10.00000 50.00000 Meat and meat products, including poultry and game (08.0): 2.00000 10.00000 Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): 2.00000 10.00000 Eggs and egg products (10.0): - - Sweeteners, including honey (11.0): - - Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 5.00000 25.00000 Foodstuffs intended for particular nutritional uses (13.0): 10.00000 50.00000 Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 5.00000 25.00000 Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 10.00000 50.00000 Ready-to-eat savouries (15.0): 20.00000 100.00000 Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 5.00000 25.00000   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 2, Revision 1 (FGE.02) : Branched- and straight-chain aliphatic saturated primary alcohols and related esters of primary alcohols and straight-chain carboxylic acids and one straight-chain aldehyde from chemical groups 1 and 2 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) 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 :12296 National Institute of Allergy and Infectious Diseases:Data WISER:UN 1987 WGK Germany:3 4-methylpentan-1-ol Chemidplus:0000626891 RTECS:NR3020000 for cas# 626-89-1   References:   4-methylpentan-1-ol NIST Chemistry WebBook: Search Inchi Pubchem (cid): 12296 Pubchem (sid): 134978501 Pherobase: View   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 CHEMBL: View HMDB (The Human Metabolome Database): Search YMDB (Yeast Metabolome Database): YMDB01348 Export Tariff Code: 2905.19.9090 VCF-Online: VCF Volatile Compounds in Food ChemSpider: View Wikipedia: View   Potential Blenders and core components note None Found   Potential Uses: None Found   Occurrence (nature, food, other):note   brandy grape brandy Search PMC Picture   plum fruit Search Trop Picture   poplar black poplar leaf Search Trop Picture   tobacco Search Trop Picture   wine Search Picture   Synonyms: iso hexanol 4-iso hexyl alcohol iso hexyl alcohol 4- methyl pentan-1-ol 2- methyl-5-pentanol 4- methylpentan-1-ol 4- methylpentanol   pentan-1-ol, 4-methyl-   pentanol, 4-methyl- 1- pentanol, 4-methyl- (9CI)   Articles:   None found yet. Try the PubMed Search.

Notes: None found