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furfuryl thiobutyrate

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Name:O-(2-furylmethyl) butanethioate
CAS not foundNF0075Picture of molecule3D/inchi
XlogP3-AA:2.10 (est)
Molecular Weight:184.25804000
Formula:C9 H12 O2 S
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:information only not used for fragrances or flavors
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
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 245.00 to 246.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.045000 mmHg @ 25.00 °C. (est)
Flash Point: 216.00 °F. TCC ( 102.20 °C. ) (est)
logP (o/w): 2.831 (est)
Soluble in:
 water, 148.7 mg/L @ 25 °C (est)
Insoluble in:
Organoleptic Properties:
Flavor Type: coffee
Taste Description: coffee
Odor and/or flavor descriptions from others (if found).
Cosmetic Information:
None found
Ambles Nature et Chimie
M&U International
Sunaux International
Furfuryl Thiobutyrate
Tengzhou Jitian Aroma Chemiclal
Furfuryl Thiobutyrate
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
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:
information only not used for fragrances or flavors
Recommendation for furfuryl thiobutyrate usage levels up to:
 not for fragrance use.
Recommendation for furfuryl thiobutyrate flavor usage levels up to:
 not for flavor use.
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
Laboratory Chemical Safety Summary :44182042
O-(2-furylmethyl) butanethioate
 O-(2-furylmethyl) butanethioate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):44182042
Pubchem (cas):NF0075
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
Potential Blenders and core components note
None Found
Potential Uses:
None Found
Occurrence (nature, food, other):note
 not found in nature
 furfuryl thiol butyrate
1-(2-furyl methoxy) butane-1-thione
O-(2-furyl methyl) butane thioate
O-(2-furylmethyl) butanethioate
None found
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