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

diisobutyl adipate
bis(2-methylpropyl) hexanedioate

Supplier Sponsors

Name:bis(2-methylpropyl) hexanedioate
CAS Number: 141-04-8Picture of molecule3D/inchi
Other:53659-85-1
ECHA EINECS - REACH Pre-Reg:205-450-3
FDA UNII:8OPY05ZY7S
Nikkaji Web:J26.287K
Beilstein Number:1791084
MDL:MFCD00053722
XlogP3-AA:3.20 (est)
Molecular Weight:258.35802000
Formula:C14 H26 O4
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome or firefox)
Category:food-contact surface of paper and paperboard
 
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
JECFA Food Flavoring:1967 diisobutyl adipate
FEMA Number:4475 diisobutyl adipate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):141-04-8 ; DIISOBUTYL ADIPATE
FDA Mainterm (IAUFC):141-04-8 ; DIISOBUTYL ADIPATE

FDA Regulation:
FDA PART 175 -- INDIRECT FOOD ADDITIVES: ADHESIVES AND COMPONENTS OF COATINGS
Subpart B--Substances for Use Only as Components of Adhesives
Sec. 175.105 Adhesives.


FDA PART 175 -- INDIRECT FOOD ADDITIVES: ADHESIVES AND COMPONENTS OF COATINGS
Subpart C--Substances for Use as Components of Coatings
Sec. 175.300 Resinous and polymeric coatings.


FDA PART 181 -- PRIOR-SANCTIONED FOOD INGREDIENTS
Subpart B--Specific Prior-Sanctioned Food Ingredients
Sec. 181.27 Plasticizers.
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.95000 to 0.95600 @ 20.00 °C.
Pounds per Gallon - (est).: 7.914 to 7.964
Refractive Index:1.42800 to 1.43400 @ 20.00 °C.
Melting Point: -20.00 °C. @ 760.00 mm Hg
Boiling Point: 279.00 °C. @ 760.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure:0.004000 mmHg @ 25.00 °C. (est)
Flash Point: 235.00 °F. TCC ( 112.78 °C. )
logP (o/w): 3.695 (est)
Soluble in:
 alcohol
 water, 5.649 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Strength:low
Odor Description:at 100.00 %. mild estery
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: emollients
masking agents
plasticisers
skin conditioning
solvents
 
Suppliers:
Alzo International
Dermol DIBA
Axsyn
For experimental / research use only.
Hexanedioic acid,1,6-bis(2-methylpropyl) ester
BOC Sciences
For experimental / research use only.
Diisobutyl Adipate
Carbosynth
For experimental / research use only.
Diisobutyl Adipate
Grau Aromatics
DI-iso-BUTYL-ADIPATE
NI
HallStar
HALLTRESS® DIBA SPECIAL
Odor: characteristic
Use: HallTress DIBA is a multifunctional (plasticizer, emollient, solvent), synthetically produced diester of Isobutyl Alcohol and Adipic Acid. It is non-occlusive, non-oily, is mildly drying and has fast spreading action and good solvent properties. It finds application as a plasticizer for hair fixatives and nail polishes and enamels and as a hydro-alcoholic coupler for colognes and toilet waters. It also finds application as an emollient, skin conditioner, solvent, penetrant, superfatting agent, and pigment wetter/dispersant in bath products and skin lotions and as a relatively polar solid UV filter solvent in sunscreens.
HallStar
PLASTHALL® DIBA
Odor: characteristic
Use: PLASTHALL DIBA is diisobutyl adipate. It imparts low temperature flexibility but has poor permanence. PLASTHALL DIBA is also effective at solvating various polymers. It has compatibility with many lower polarity polymers.
Inoue Perfumery
DIISOBUTYL ADIPATE
Kao Corporation
VINYCIZER 40(DIBA)
Odor: characteristic
Use: Secondary plasticizer for Plastics. Films, sheets, leathers, hose, tile and plastisol.
Penta International
DIISOBUTYL ADIPATE
Santa Cruz Biotechnology
For experimental / research use only.
Diisobutyl Adipate
Sigma-Aldrich: Aldrich
For experimental / research use only.
Diisobutyl adipate 99%
SRS Aromatics
DI ISO BUTYL ADIPATE
TCI AMERICA
For experimental / research use only.
Diisobutyl Adipate >99.0%(GC)
 
Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
None - None found.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
 
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:
oral-guinea pig LD50 12300 ul/kg
German Offenlegungsschrift Patent Document. Vol. #2703360

intraperitoneal-rat LD50 5950 ul/kg
Journal of Pharmaceutical Sciences. Vol. 62, Pg. 1596, 1973.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: food-contact surface of paper and paperboard
Recommendation for diisobutyl adipate usage levels up to:
 not for fragrance use.
 
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 24
 average usual ppmaverage maximum ppm
baked goods: 5.0000010.00000
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: --
cheese: 5.0000010.00000
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: 5.0000010.00000
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: --
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: 5.0000010.00000
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: 5.0000010.00000
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --
 
Safety References:
EPI System: View
NLM Hazardous Substances Data Bank:Search
Chemical Carcinogenesis Research Information System:Search
NLM Developmental and Reproductive Toxicity:Search
EPA Substance Registry Services (TSCA):141-04-8
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :8831
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:1
bis(2-methylpropyl) hexanedioate
Chemidplus:0000141048
RTECS:AV1480000 for cas# 141-04-8
 
References:
 bis(2-methylpropyl) hexanedioate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:141-04-8
Pubchem (cid):8831
Pubchem (sid):134975093
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
FDA Substances Added to Food (formerly EAFUS):View
FDA Indirect Additives used in Food Contact Substances:View
CHEBI:View
CHEMBL:View
KEGG (GenomeNet):C14260
HMDB (The Human Metabolome Database):HMDB41618
FooDB:FDB021779
Export Tariff Code:2917.19.2700
Haz-Map:View
Household Products:Search
ChemSpider:View
Wikipedia:View
RSC Learn Chemistry:View
FAO:Diisobutyl adipate
 
Potential Blenders and core components note
None Found
 
Potential Uses:
 emollients
 fixer
 plasticisers
 skin conditioning
 solvents
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 adipic acid bis(2-methylpropyl) ester
 adipic acid di-isobutyl ester
 adipic acid diisobutyl ester
 adipic acid, diisobutyl ester
isobutyl adipate
 di-iso-butyl-adipate
 DIBA
 diisobutyl hexane dioate
 diisobutyl hexanedioate
 diisobutyladipate
 ftaflex DIBA
 hexane dioic acid bis(2-methyl propyl) ester
 hexanedioic acid bis(2-methylpropyl) ester
 hexanedioic acid, bis (2-methylpropyl) ester
 hexanedioic acid, bis(2-methylpropyl) ester
 hexanedioic acid, di-C4-13-branched alkyl esters
 hexanedioic acid, diisobutyl ester
 hexanedioic acid,1,6-bis(2-methylpropyl) ester
bis(2-methyl propyl) hexane dioate
bis(2-methylpropyl) hexanedioate
bis(2-methylpropyl)hexanedioate
 plasthall DIBA
 uniplex 165
 
 
Notes:
Food additive [Goodscents]
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