2,4-dimethyl-3-pentanone
3-pentanone, 2,4-dimethyl-

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  CODE116428 CODE116428
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  04-61850 2,4-DIMETHYL-3-PENTANONE

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  Product(s):
  D0770 2,4-Dimethyl-3-pentanone >98.0%(GC)
  SDS

CAS Number: 565-80-0 3D/inchi ECHA EINECS - REACH Pre-Reg: 209-294-7 FDA UNII: 7AAP3A50IG Nikkaji Web: J6.514E Beilstein Number: 773782 MDL: MFCD00008918 XlogP3: 1.90 (est) Molecular Weight: 114.18778000 Formula: C7 H14 O BioActivity Summary: listing NMR Predictor: Predict (works with chrome, Edge or firefox) Category:natural substances and extractives   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: 0.80300 to 0.80600 @ 20.00 °C. Pounds per Gallon - (est).: 6.690 to 6.715 Refractive Index: 1.39900 to 1.40100 @ 20.00 °C. Boiling Point: 125.40 °C. @ 760.00 mm Hg Vapor Pressure: 13.400000 mmHg @ 25.00 °C. Flash Point: 60.00 °F. TCC ( 15.56 °C. ) logP (o/w): 1.860 Soluble in:   alcohol   water, 5700 mg/L @ 25 °C (exp) Insoluble in:   water   Organoleptic Properties: Flavor Type: acetone acetone Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: Penta International 2,4-DIMETHYL-3-PENTANONE Santa Cruz Biotechnology For experimental / research use only. 2,4-Dimethyl-3-pentanone Sigma-Aldrich: Aldrich For experimental / research use only. 2,4-Dimethyl-3-pentanone 98% sds TCI AMERICA For experimental / research use only. 2,4-Dimethyl-3-pentanone >98.0%(GC) sds   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. Oral/Parenteral Toxicity: oral-rat LD50 3536 mg/kg United States Environmental Protection Agency, Office of Pesticides and Toxic Substances. Vol. 8EHQ-0990-1062 Dermal Toxicity: skin-rat LD50 > 16120 mg/kg United States Environmental Protection Agency, Office of Pesticides and Toxic Substances. Vol. 8EHQ-0990-1062 Inhalation Toxicity: inhalation-rat LC50 > 2765 ppm/6H United States Environmental Protection Agency, Office of Pesticides and Toxic Substances. Vol. 8EHQ-0990-1062   Safety in Use Information: Category: natural substances and extractives Recommendation for 2,4-dimethyl-3-pentanone usage levels up to:   not for fragrance use.   Recommendation for 2,4-dimethyl-3-pentanone flavor usage levels up to:   not for flavor use.   Safety References: EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):565-80-0 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :11271 National Institute of Allergy and Infectious Diseases:Data WGK Germany:1 2,4-dimethylpentan-3-one Chemidplus:0000565800 RTECS:SA8575500 for cas# 565-80-0   References:   2,4-dimethylpentan-3-one NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 565-80-0 Pubchem (cid): 11271 Pubchem (sid): 134978643   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): HMDB31429 FooDB: FDB003508 Export Tariff Code: 2914.19.0000 VCF-Online: VCF Volatile Compounds in Food ChemSpider: View   Potential Blenders and core components note None Found   Potential Uses: None Found   Occurrence (nature, food, other):note   guava fruit Search Trop Picture   lavender oil Search Trop Picture   Synonyms: iso butyrone   diisopropyl ketone   diisopropylketone 2,4- dimethyl pentan-3-one 2,4- dimethylpentan-3-one   ketone, di-isopropyl 3- pentanone, 2,4-dimethyl- iso propyl ketone   Articles: US Patents:3,952,024 - Furfurylthioacetone US Patents:Certain 2,5-dimethyl-3-thiopyrazines

Notes: Isol. from lavender oil (Lavendula officinalis hybrid)