EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

3,6-octane dione
3,6-octanedione

Supplier Sponsors

Name:octane-3,6-dione
CAS Number: 2955-65-9Picture of molecule3D/inchi
FDA UNII: 56742H0Z37
Nikkaji Web:J427.195E
XlogP3-AA:0.50 (est)
Molecular Weight:142.19798000
Formula:C8 H14 O2
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
PubMed:Search
NCBI:Search
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 227.00 to 228.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.078000 mmHg @ 25.00 °C. (est)
Flash Point: 180.00 °F. TCC ( 82.40 °C. ) (est)
logP (o/w): 0.928 (est)
Soluble in:
 water, 5.859e+004 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Octane-3,6-dione
Kingchem Laboratories
3,6-Octanedione
Santa Cruz Biotechnology
For experimental / research use only.
3,6-Octanedione
 
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:
information only not used for fragrances or flavors
Recommendation for 3,6-octane dione usage levels up to:
 not for fragrance use.
 
Recommendation for 3,6-octane dione 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 :165054
National Institute of Allergy and Infectious Diseases:Data
octane-3,6-dione
Chemidplus:0002955659
 
References:
 octane-3,6-dione
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):165054
Pubchem (sid):135121179
 
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
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 octane-3,6-dione
3,6-octanedione
 
 
Notes:
None found
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