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laevo-menthyl isobutyrate
2-methyl propanoic acid (1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester

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CAS Number: 68366-65-4Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:269-862-5
XlogP3-AA:4.60 (est)
Molecular Weight:226.35962000
Formula:C14 H26 O2
NMR Predictor:Predict (works with chrome 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
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Google Scholar: with word "odor"Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 252.00 to 253.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.019000 mm/Hg @ 25.00 °C. (est)
Flash Point: 234.00 °F. TCC ( 112.22 °C. )
logP (o/w): 5.045 (est)
Soluble in:
 alcohol
 water, 0.9565 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: herbal
Odor Strength:medium
sweet herbal sage clary sage rose
Odor Description:at 100.00 %. sweet herbal clary sage rose
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
L-Menthyl Isobutyrate
Inoue Perfumery
L-MENTHYL ISOBUTYRATE
Synerzine
L-Menthyl Isobutyrate
 
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: information only not used for fragrances or flavors
Recommendation for laevo-menthyl isobutyrate usage levels up to:
 not for fragrance use.
 
Recommendation for laevo-menthyl isobutyrate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):68366-65-4
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :109319
National Institute of Allergy and Infectious Diseases:Data
(5-methyl-2-propan-2-ylcyclohexyl) 2-methylpropanoate
Chemidplus:0068366654
 
References:
 (5-methyl-2-propan-2-ylcyclohexyl) 2-methylpropanoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):109319
Pubchem (sid):135066793
 
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:
(-)-menthyl isobutyrate
L-menthyl isobutyrate
2-methyl propanoic acid (1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester
(1R-(1alpha, 2beta,5alpha))-5-methyl-2-(1-methyl ethyl) cyclohexyl isobutyrate
(1R-(1a,2b,5a))-5-methyl-2-(1-methylethyl)cyclohexyl isobutyrate
(1R-(1alpha,2beta,5alpha))-5-methyl-2-(1-methylethyl)cyclohexyl isobutyrate
(5-methyl-2-propan-2-ylcyclohexyl) 2-methylpropanoate
 

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Notes:
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