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damascate
2-(1,1-dimethylethyl)-4-methyl cyclohexanol acetate

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Name:(2-tert-butyl-4-methylcyclohexyl) acetate
CAS Number: 115724-27-1Picture of molecule3D/inchi
XlogP3-AA:3.80 (est)
Molecular Weight:212.33268000
Formula:C13 H24 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:
Assay: 95.00 to 100.00 sum of isomers
Food Chemicals Codex Listed: No
Specific Gravity:0.92500 @ 25.00 °C.
Boiling Point: 234.00 to 235.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.050000 mm/Hg @ 25.00 °C. (est)
Flash Point: 204.00 °F. TCC ( 96.00 °C. )
logP (o/w): 4.449 (est)
Soluble in:
 alcohol
 water, 2.778 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:medium ,
recommend smelling in a 10.00 % solution or less
floral rose tropical fruity
Odor Description:at 10.00 % in dipropylene glycol. fresh floral rose tropical fruity
Odor and/or flavor descriptions from others (if found).
Tadimety Aromatics
Rosascone
Odor Description:Fresh, floral, with typical Rose and Damascone notes
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
EMD Millipore
For experimental / research use only.
(2-tert-Butyl-4-methylcyclohexyl) acetate
Tadimety Aromatics
Rosascone
Odor: Fresh, floral, with typical Rose and Damascone notes
 
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:
oral-rat LD50 > 5000 mg/kg

Dermal Toxicity:
skin-rat LD50 > 2000 mg/kg

Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: fragrance agents
 
Recommendation for damascate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):115724-27-1
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :16206258
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
(2-tert-butyl-4-methylcyclohexyl) acetate
Chemidplus:0115724271
 
References:
 (2-tert-butyl-4-methylcyclohexyl) acetate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):16206258
Pubchem (sid):135214593
 
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
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
2-tert-butyl-4-methyl cyclohexanol acetate
(2-tert-butyl-4-methylcyclohexyl) acetate
 damascate
2-(1,1-dimethyl ethyl)-4-methyl cyclohexanol acetate
2-(1,1-dimethylethyl)-4-methyl cyclohexanol acetate
 rosascone (Tadimety)
 

Articles:

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Notes:
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