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General Material Information

Preferred name isomaltol
Trivial Name Isomaltol
Short Description ethanone, 1-(3-hydroxy-2-furanyl)-
Formula C6 H6 O3
CAS Number 3420-59-5
FDA UNII 76NST80C38
Nikkaji Number J209.320K
xLogP3-AA 1.20 (est)
NMR Predictor External link
Synonyms
  • 2-acetyl-3-hydroxyfuran
  • ethanone, 1-(3-hydroxy-2-furanyl)-
  • 1-(3-hydroxy-2-furanyl)ethanone
  • 3-hydroxy-2-furyl methyl ketone
  • 1-(3-hydroxy-2-furyl)ethanone
  • 1-(3-hydroxyfuran-2-yl)ethanone
  • 1-(3-hydroxyfuran-2-yl)ethanone
  • Ketone, 3-hydroxy-2-furyl methyl
  • 1-(3-Hydroxy-2-furanyl)ethanone
  • 2-Acetyl-3-hydroxyfuran
  • 1-(3-Hydroxyfuran-2-yl)ethan-1-one

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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
HMDB (The Human Metabolome Database):Search
FooDB:FDB011190
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
EFSA Update of results on the monitoring of furan levels in food:Read Report
EFSA Previous report: Results on the monitoring of furan levels in food:Read Report
EFSA Report of the CONTAM Panel on provisional findings on furan in food:Read Report

Suppliers

BOC Sciences

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 126.11141967773
Boiling Point 207 to 208°C @ 760 mm Hg
Vapor Pressure 0.158 mmHg @ 25 °C
Flash Point TCC Value 79.2 °C TCC
logP (o/w) 0.688 est
Solubility
alcohol Yes
water, 5.12e+004 mg/L @ 25 °C (est) Yes

Organoleptic Properties

Odor Type: Caramellic
burnt, caramellic, fruity
General comment At 1.00 % in dipropylene glycol. burnt caramellic fruity

Occurrences

Safety Information

Safety information

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:
natural substances and extractives
Recommendation for isomaltol usage levels up to:
not for fragrance use.
Recommendation for isomaltol flavor usage levels up to:
not for flavor use.

Safety references

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 :18898
National Institute of Allergy and Infectious Diseases:Data
1-(3-hydroxyfuran-2-yl)ethanone
Chemidplus:0003420595