ethyl-4-hydroxymethyl-3(2H)-furanone
4-hydroxy-2(or 5)-ethyl-5(or 2)-methyl-3(2H)-furanone
 
Notes:
Flavouring compound [Flavornet]
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CAS Number: 110516-60-4Picture of molecule3D/inchi
MDL: MFCD03411593
XlogP3-AA: 0.70 (est)
Molecular Weight: 142.15430000
Formula: C7 H10 O3
NMR Predictor: Predict (works with chrome or firefox)
Category: natural substances and extractives
 
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 277.00 to  278.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.001000 mmHg @ 25.00 °C. (est)
Flash Point: 242.00 °F. TCC ( 116.67 °C. )
logP (o/w): 0.567 (est)
Soluble in:
 water, 7.797e+005 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor Type: caramellic
 
 caramellic  
Odor Description:
at 0.10 % in propylene glycol. 
caramel
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
Sigma-Aldrich
For experimental / research use only.
5(or2)-Ethyl-4-hydroxy-2(or5)-methyl-3(2H)-furanone analytical standard
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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
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Safety in Use Information:
Category: natural substances and extractives
Recommendation for ethyl-4-hydroxymethyl-3(2H)-furanone usage levels up to:
 not for fragrance use.
 
Recommendation for ethyl-4-hydroxymethyl-3(2H)-furanone flavor usage levels up to:
 not for flavor use.
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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 : 3066538
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 3
 2-ethyl-4-(hydroxymethyl)furan-3-one
Chemidplus: 0110516604
RTECS: LU4312500 for cas# 110516-60-4
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References:
 2-ethyl-4-(hydroxymethyl)furan-3-one
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 3066538
Pubchem (sid): 135189360
Flavornet: 110516-60-4
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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: FDB029686
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: 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
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 pistacia terebinthus
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Synonyms:
2-ethyl-4-(hydroxymethyl)furan-3-one
2(or 5)-ethyl-4-hydroxy-5(or 2)-methyl-3(2H)-furanone
4-hydroxy-2(or 5)-ethyl-5(or 2)-methyl-3(2H)-furanone
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