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

monomethyl adipate
hexanedioic acid, monomethyl ester

Supplier Sponsors

CAS Number: 627-91-8Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:211-019-0
FDA UNII: 62S39VHD01
Nikkaji Web:J21.775A
Beilstein Number:1766411
MDL:MFCD00004418
XlogP3:0.70 (est)
Molecular Weight:160.16944000
Formula:C7 H12 O4
BioActivity Summary:listing
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
Specific Gravity:1.12300 to 1.12700 @ 20.00 °C.
Pounds per Gallon - (est).: 9.355 to 9.389
Refractive Index:1.43900 to 1.44300 @ 20.00 °C.
Melting Point: 9.00 °C. @ 760.00 mm Hg
Boiling Point: 291.61 °C. @ 760.00 mm Hg (est)
Flash Point:> 230.00 °F. TCC ( > 110.00 °C. )
logP (o/w): 0.500 (est)
Soluble in:
 water, 1.948e+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.
mono-Methyl adipate 95%
EMD Millipore
For experimental / research use only.
monoMethyl Adipate
Santa Cruz Biotechnology
For experimental / research use only.
monoMethyl Adipate
Sigma-Aldrich: Aldrich
For experimental / research use only.
monoMethyl Adipate 99%
TCI AMERICA
For experimental / research use only.
monoMethyl Adipate >97.0%(GC)(T)
 
Safety Information:
Preferred SDS: View
 
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 monomethyl adipate usage levels up to:
 not for fragrance use.
 
Recommendation for monomethyl 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 Substance Registry Services (TSCA):627-91-8
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :12328
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
6-methoxy-6-oxohexanoic acid
Chemidplus:0000627918
 
References:
 6-methoxy-6-oxohexanoic acid
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):12328
Pubchem (sid):135269685
 
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
CHEBI:View
CHEMBL:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2917.12.5000
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 adipic acid monomethyl ester
 hexane dioic acid monomethyl ester
 hexanedioic acid, monomethyl ester
6-methoxy-6-oxohexanoic acid
monomethyl 1,6-hexane dioate
 methyl 5-carboxypentanoate
 methyl hemiadipate
 methyl hydrogen adipate
 
 
Notes:
None found
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