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butyl sorbate
2,4-hexadienoic acid, butyl ester, (E,E)-

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Name:butyl (2E,4E)-hexa-2,4-dienoate
CAS Number: 7367-78-4Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:230-911-0
FDA UNII: PGD652VR5M
Nikkaji Web:J8.926E
XlogP3-AA:2.80 (est)
Molecular Weight:168.23592000
Formula:C10 H16 O2
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:flavor and fragrance agents
 
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
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 221.00 to 223.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.081000 mmHg @ 25.00 °C. (est)
Flash Point: 207.00 °F. TCC ( 97.22 °C. )
logP (o/w): 3.435 (est)
Soluble in:
 alcohol
 water, 81.27 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Frinton Laboratories
For experimental / research use only.
Butyl Sorbate
Grau Aromatics
BUTYL-SORBATE
SRS Aromatics
BUTYL SORBATE
 
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:
flavor and fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
 
 
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 :5369076
National Institute of Allergy and Infectious Diseases:Data
butyl (2E,4E)-hexa-2,4-dienoate
Chemidplus:0007367784
 
References:
 butyl (2E,4E)-hexa-2,4-dienoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):5369076
Pubchem (sid):135054164
Pherobase:View
 
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
CHEMBL:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2916.19.4000
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
 found in nature
 
Synonyms:
 butyl (2E,4E)-hexa-2,4-dienoate
 butyl (E,E)-hexa-2,4-dienoate
(2E,4E)-butyl hexa-2,4-dienoate
N-butyl sorbate
 butyl-sorbate
(E,E)-hexa-2,4-dienoate, butyl-
 hexa-2,4-dienoic acid butyl ester
2,4-hexadienoic acid, butyl ester, (2E,4E)-
2,4-hexadienoic acid, butyl ester, (E,E)-
 
 
Notes:
None found
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