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benzyl octyl adipate
hexanedioic acid, octyl phenylmethyl ester

Supplier Sponsors

Name:6-O-benzyl 1-O-octyl hexanedioate
CAS Number: 3089-55-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:221-431-2
FDA UNII: MR5CLK3Y44
Nikkaji Web:J217.264J
MDL:MFCD00048940
XlogP3-AA:5.50 (est)
Molecular Weight:348.48284000
Formula:C21 H32 O4
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
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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: 434.24 °C. @ 760.00 mm Hg (est)
Flash Point: 404.00 °F. TCC ( 206.50 °C. ) (est)
logP (o/w): 6.238 (est)
Soluble in:
 water, 0.01669 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.
Benzyl Octyl Adipate
Matrix Scientific
For experimental / research use only.
Benzyl octyl adipate, 95+%
 
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 benzyl octyl adipate usage levels up to:
 not for fragrance use.
 
Recommendation for benzyl octyl adipate 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 :76534
National Institute of Allergy and Infectious Diseases:Data
6-O-benzyl 1-O-octyl hexanedioate
Chemidplus:0003089552
 
References:
 6-O-benzyl 1-O-octyl hexanedioate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:3089-55-2
Pubchem (cid):76534
Pubchem (sid):135036132
 
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:
6-O-benzyl 1-O-octyl hexanedioate
 hexane dioic acid octyl phenyl methyl ester
 hexanedioic acid, octyl phenylmethyl ester
 
 
Notes:
None found
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