laitone
1-oxaspiro[4.5]decan-2-one, 8-(1-methylethyl)-
 
Notes:
None found
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Fragrance Demo Formulas
8-propan-2-yl-4-oxaspiro[4.5]decan-3-one (Click)
CAS Number: 4625-90-5Picture of molecule
XlogP3-AA: 2.90 (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:
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 279.00 to  281.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 0.004000 mm/Hg @ 25.00 °C. (est)
Flash Point: 234.00 °F. TCC ( 112.30 °C. ) (est)
logP (o/w): 2.745 (est)
Soluble in:
 alcohol
 water, 76.27 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
Odor Type: woody
Odor Strength: medium
 woody  herbal  celery  lactonic  
Odor Description:
at 100.00 %. 
woody herbal celery lactone
  
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
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Suppliers:
 None found
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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
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Safety in Use Information:
Category: fragrance agents
 
Recommendation for laitone flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 6452049
National Institute of Allergy and Infectious Diseases: Data
 8-propan-2-yl-4-oxaspiro[4.5]decan-3-one
Chemidplus: 0004625905
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References:
 8-propan-2-yl-4-oxaspiro[4.5]decan-3-one
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 4625-90-5
Pubchem (cid): 6452049
Pubchem (sid): 135250995
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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
Wikipedia: View
RSC Learn Chemistry: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 laitone
(E)-8-(1-methyl ethyl)-1-oxaspiro(4.5)decan-2-one
trans-8-(1-methyl ethyl)-1-oxaspiro(4.5)decan-2-one
(E)-8-(1-methylethyl)-1-oxaspiro(4.5)decan-2-one
trans-8-(1-methylethyl)-1-oxaspiro(4.5)decan-2-one
8-propan-2-yl-4-oxaspiro[4.5]decan-3-one
8-isopropyl-1-oxaspiro[4.5]decan-2-one
isopropyl-1-oxaspirodecanone
1-oxaspiro[4.5]decan-2-one, 8-(1-methylethyl)-
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