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

ocimen-1-yl acetate
ocimenyl acetate

Sponsors

Name: [(5E)-2,6-dimethylocta-5,7-dien-2-yl] acetate
CAS Number: 72214-23-4Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 276-484-4
Nikkaji Web: J299.053I
MDL: MFCD00087021
XlogP3: 3.50 (est)
Molecular Weight: 196.28980000
Formula: C12 H20 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
PubMed: Search
NCBI: Search
FEMA Number: 3886 ocimenyl acetate
 
Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity: 0.90700 to 0.91400 25.00 °C.
Pounds per Gallon - (est).: 7.547 to 7.605
Specific Gravity: 0.90800 to 0.91500 @ 20.00 °C.
Pounds per Gallon - est.: 7.564 to 7.623
Refractive Index: 1.46500 to 1.47000 @ 20.00 °C.
Boiling Point: 220.00 to 221.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.114000 mm/Hg @ 25.00 °C. (est)
Flash Point: 197.00 °F. TCC ( 91.67 °C. )
logP (o/w): 3.685 (est)
Soluble in:
 alcohol
 water, 8.197 mg/L @ 25 °C (est)
Insoluble in:
 water
Stability:
 alcoholic lotion
 antiperspirant
 deo stick
 fabric softener
 shampoo
 soap
 
Organoleptic Properties:
Odor Type: fruity
Odor Strength: medium
Substantivity: 12 hour(s) at 100.00 %
 citrus lavender cologne bergamot floral
Odor Description:
at 100.00 %.
citrus lavender cologne bergamot floral
Odor and/or flavor descriptions from others (if found).
IFF
Ocimenyl Acetate
Odor Description: Fresh, herbal citrus top note
 
Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Azelis UK
Ocimenyl Acetate
Services
BOC Sciences
For experimental / research use only.
Ocimenyl acetate
Ernesto Ventós
OCIMENYL ACETATE IFF
Odor: LAVENDER, COLOGNE
IFF
Ocimenyl Acetate
Odor: Fresh, herbal citrus top note
Liaison Carbone
OCIMEN-1-YL ACETATE
Penta International
2,6-DIMETHYL ACETATE-5,7-OCTADIEN-2-OL
Penta International
OCIMENYL ACETATE
Sigma-Aldrich: Aldrich
For experimental / research use only.
1,1,5-trimethyl-4,6-heptadienyl acetate
Taytonn
Ocimenyl Acetate
Odor: Floral, Cologne-like , Citrus, Fruity, Green
The John D. Walsh Company
Ocimenyl Acetate
 
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 ocimen-1-yl acetate usage levels up to:
  5.0000 % in the fragrance concentrate.
 
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: 18
 average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): 1.000005.00000
beverages(alcoholic): 2.0000010.00000
breakfast cereal: --
cheese: --
chewing gum: 20.00000100.00000
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: 10.0000050.00000
imitation dairy: --
instant coffee / tea: 2.0000010.00000
jams / jellies: --
meat products: --
milk products: 2.0000010.00000
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA): 72214-23-4
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 6112709
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 2
 [(5E)-2,6-dimethylocta-5,7-dien-2-yl] acetate
Chemidplus: 0072214234
 
References:
 [(5E)-2,6-dimethylocta-5,7-dien-2-yl] acetate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 72214-23-4
Pubchem (cid): 6112709
Pubchem (sid): 135120582
 
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
Export Tariff Code: 2915.39.9050
ChemSpider: View
 
Potential Blenders and core components note
For Odor
citrus
bergamot acetoacetate
FR
citronellal oxime
FR
dihydromyrcenyl acetate
FR
dimyrcetol (IFF)
FR
homo
geranyl nitrile
FR
alpha-
methylene citronellal
FR
tetrahydromyrcenyl acetate
FR
floral
bigarade oxide
FR
citronellyl ethyl ether
FR
dihydromyrcene
FR
ethyl linalool
FR
neryl ethyl ether
FR
tetrahydrolinalyl acetate
FR
fruity
nerolidyl isobutyrate
FR
green
agrumen aldehyde
FR
herbal
acorus calamus rhizome oil
FR
bergamot mint herb oil
FR
citrus ocimenol acetate
FR
eucalyptus citriodora oil
FR
cis-
herbal cyclohexane
FR
petitgrain heptane
FR
saffron pyranone
FR
oswego
tea specialty
FR
pine
dipentene terpene hydrocarbon byproducts
FR
woody
dihydro-alpha-terpinyl acetate
FR
For Flavor
 
Potential Uses:
 bergamotFR
 citrusFR
 cologneFR
 floralFR
 grapefruitFR
 herbalFR
 lavenderFR
 
Occurrence (nature, food, other): note
 not found in nature
 
Synonyms:
2,6-dimethyl-5,7-octadien-2-ol acetate
2,6-dimethyl-5,7-octadien-2-yl acetate
[(5E)-2,6-dimethylocta-5,7-dien-2-yl] acetate
 ocimen-1-yl acetate
 ocimenyl acetate
5,7-octadien-2-ol, 2,6-dimethyl-, acetate
1,1,5-trimethyl hepta-4,6-dienyl acetate
1,1,5-trimethylhepta-4,6-dienyl acetate
 
 
Notes:
None found
 
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