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diisobutyl carbinyl acetate
alicate (Givaudan)

Sponsors

CAS Number: 10250-45-0Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:233-588-4
Nikkaji Web:J227.138I
XlogP3-AA:3.60 (est)
Molecular Weight:186.29474000
Formula:C11 H22 O2
NMR Predictor:Predict (works with chrome or firefox)
Category: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
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 193.00 to 194.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.454000 mm/Hg @ 25.00 °C. (est)
Flash Point: 161.00 °F. TCC ( 71.67 °C. )
logP (o/w): 3.884 (est)
Soluble in:
 alcohol
 water, 16.77 mg/L @ 25 °C (est)
Stability:
 alcoholic - good
 antiperspirant spray - moderate
 APC (pH = 10) - poor
 candles - good
 damp fabric - good
 dry fabric - good
 liquid bleach - poor
 pH = 2 - moderate
 powder detergent - moderate
 powder detergent + activator - moderate
 soap - good
 toiletries - good
 
Organoleptic Properties:
Odor Type: herbal
Odor Strength:medium
herbal rhubarb floral lilac banana
Odor Description:at 100.00 %. herbal rhubarb floral lilac banana
Odor and/or flavor descriptions from others (if found).
Givaudan
Alicate
Odor Description:Fruity, Herbaceous, Rhubarb, Floral
Alicate is a fresh herbal note with hints of rhubarb and banana with a lilac background. It gives excellent performance and stability across the range of toiletry, soaps and detergents. Alicate blends well with fruity, citrus and herbal ingredients and gives a boost to top-note freshness.
Pell Wall Perfumes
Alicate
Odor Description:Floral-lilac, Fruity, Herbaceous, Rhubarb
It gives excellent performance and stability across the range of toiletry, soaps and detergents. Blends well with fruity, citrus and herbal ingredients and gives a boost to top-note freshness.
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
3-methyl-1-isobutylbutyl acetate 95%
CG Herbals
Alicate
Odor: Fruity, Herbaceous, Rhubarb, Floral
Use: Alicate has a fresh herbal note with hints of rhubarb and banana with a lilac background. It gives excellent performance and stability across the range of toiletry, soaps and detergents. Alicate blends well with fruity, citrus and herbal ingredients and gives a boost to top-note freshness.
Givaudan
Alicate
Odor: Fruity, Herbaceous, Rhubarb, Floral
Use: Alicate is a fresh herbal note with hints of rhubarb and banana with a lilac background. It gives excellent performance and stability across the range of toiletry, soaps and detergents. Alicate blends well with fruity, citrus and herbal ingredients and gives a boost to top-note freshness.
Pell Wall Perfumes
Alicate
Odor: Floral-lilac, Fruity, Herbaceous, Rhubarb
Use: It gives excellent performance and stability across the range of toiletry, soaps and detergents. Blends well with fruity, citrus and herbal ingredients and gives a boost to top-note freshness.
Perfumery Laboratory
Alicata Givaudan
Odor: Flower (lilac), fruity (banana), juicy grass aroma with a distinct tinge of rhubarb
 
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: fragrance agents
Recommendation for diisobutyl carbinyl acetate usage levels up to:
  15.0000 % in the fragrance concentrate.
 
Recommendation for diisobutyl carbinyl acetate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):10250-45-0
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :82493
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
2,6-dimethylheptan-4-yl acetate
Chemidplus:0010250450
 
References:
 2,6-dimethylheptan-4-yl acetate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:10250-45-0
Pubchem (cid):82493
Pubchem (sid):135040228
 
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
HMDB (The Human Metabolome Database):Search
ChemSpider:View
 
Potential Blenders and core components note
For Odor
citrus
grapefruit pentanol
FR
rhubafuran
FR
tetrahydromyrcenol
FR
tetrahydromyrcenol
FR
floral
para-
anisaldehyde dimethyl acetal
FR
hawthorn ethanol
FR
3-(4-
hydroxy-4-methyl cyclohexyl) butanal
FR
leerall
FR
fruity
rhubarb pyran
FR
rhubarb undecane
FR
herbal
chrysanthemum ketone
FR
methyl cyclogeranate (Firmenich)
FR
spicy
carnation absolute
FR
woody
rhubarb oxirane
FR
For Flavor
 
Potential Uses:
FRfloral
FRlilac lilas syringa
FRrhubarb
 tropical
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 alicate (Givaudan)
 diisobutylcarbinyl acetate
2,6-dimethyl-4-heptanol acetate
2,6-dimethyl-4-heptanol, acetate
2,6-dimethyl-4-heptyl acetate
2,6-dimethylheptan-4-yl acetate
4-heptanol, 2,6-dimethyl-, acetate
3-methyl-1-(2-methyl propyl) butyl acetate
3-methyl-1-(2-methylpropyl)butyl acetate
3-methyl-1-isobutyl butyl acetate
3-methyl-1-isobutylbutyl acetate
 

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