laitone
1-oxaspiro[4.5]decan-2-one, 8-(1-methylethyl)-
 
Notes:
None found
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Fragrance Demo Formulas
CAS Number: 4625-90-5Picture of molecule3D/inchi
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 mmHg @ 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
 
 woody  herbal  celery  lactonic  
Odor Description:
at 100.00 %. 
woody herbal celery lactone
 
Odor and/or flavor descriptions from others (if found).
 
 
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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
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
 
Recommendation for laitone flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
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 2011 (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
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Potential Blenders and core components note
 
For Odor
amber
 angelica archangelica root oil CO2 extractFL/FR
animal
1-oxaspiro-4,7-dodecaneFR
anisic
3-pentyl bicyclo[3.2.1]-6-octen-2-oneFR
balsamic
dextro,laevo-isoborneolFL/FR
isobornyl propionateFL/FR
 cedar forest fragranceFR
 conifer acetateFR
camphoreous
dextro-camphorFL/FR
citrus
 neroli ketoneFR
earthy
2-octanoneFL/FR
floral
 aglaia odorata absoluteFR
 bigarade oxideFR
 ho leaf oilFR
 karo karounde absoluteFR
 karo karounde absolute replacerFR
 petitgrain bigarade oilFL/FR
 sambucus nigra flower oil CO2 extractFR
5-tricyclodecenyl acetateFR
fruity
3-benzyl-4-heptanoneFL/FR
3-butyl bicyclo[3.2.1]-6-octen-2-oneFR
epsilon-dodecalactoneFL/FR
green
isobutyl benzyl carbinolFL/FR
isocyclocitral (IFF)FL/FR
 dicyclopentadiene propionateFR
alpha-hexyl cinnamaldehyde dimethyl acetalFR
para-methyl hydratropaldehydeFL/FR
hay
 tobacco leaf absoluteFL/FR
herbal
1-allyl-2,2,7,7-tetramethyl cycloheptanolFR
 angelica archangelica seed extractFL/FR
 artemisia vestita wall. leaf oilFR
 bornyl 2-methyl butyrateFL/FR
 bornyl butyrateFL/FR
beta-bourboneneFL/FR
 calamintha clinopodium oilFR
 cardamom liquid resinFR
 dill seed oilFL/FR
 dill seed oil CO2 extractFL/FR
 herbal undecanoneFR
 immortelle flower oilFL/FR
 lavandin water absoluteFL/FR
 levisticum officinale herb oilFL/FR
 levisticum officinale root absoluteFL/FR
 levisticum officinale root tinctureFL/FR
2-methyl butyl salicylateFL/FR
alpha-pineneFL/FR
 pinocarveolFL/FR
 thyme oil wild or creepingFL/FR
minty
 pennyroyal oilFL/FR
musk
 angelica root absoluteFL/FR
nutty
 pentanoic acid, 3-methyl-2-oxo-, ethyl esterFL/FR
orris
para-isopropyl acetophenoneFL/FR
spicy
 bayberry fragranceFR
 cardamom seed oil CO2 extractFL/FR
 cinnamon acroleinFL/FR
 ginger oleoresin africaFL/FR
 ginger root absoluteFL/FR
 ginger root oil cochinFL/FR
 maja fragranceFR
 myrceneFR
2-octanolFL/FR
black pepper absoluteFL/FR
white pepper oilFL/FR
black pepper oilFL/FR
black pepper oleoresinFL/FR
4-isopropyl-2-cyclohexenoneFL/FR
thujonic
 cedarleaf oil western redFR
common tansy flower oil argentinaFL/FR
 woody ketoneFL/FR
woody
 angelica archangelica root extractFL/FR
 angelica archangelica root tinctureFL/FR
 angelica archangelica root waterFL/FR
 cadineneFL/FR
(+)-campheneFL/FR
 campheneFL/FR
 cypress essenceFR
 dalbergia sissoo leaf oilFR
 dihydro-alpha-terpinyl acetateFR
 fougere woody fragranceFR
 manevoro oilFR
 marine formateFR
 melaleuca bracteata leaf oilFR
 polylimoneneFL/FR
 santol pentenolFR
 tetrahydromugolFR
 
For Flavor
 
No flavor group found for these
 angelica archangelica root extractFL/FR
 angelica archangelica root oil CO2 extractFL/FR
 angelica archangelica root tinctureFL/FR
 angelica archangelica root waterFL/FR
 bornyl 2-methyl butyrateFL/FR
 bornyl butyrateFL/FR
beta-bourboneneFL/FR
(+)-campheneFL/FR
epsilon-dodecalactoneFL/FR
2-methyl butyl salicylateFL/FR
 polylimoneneFL/FR
4-isopropyl-2-cyclohexenoneFL/FR
 woody ketoneFL/FR
amber
isobutyl benzyl carbinolFL/FR
balsamic
isobornyl propionateFL/FR
camphoreous
dextro,laevo-isoborneolFL/FR
 campheneFL/FR
 pinocarveolFL/FR
citrus
 petitgrain bigarade oilFL/FR
dairy
2-octanoneFL/FR
fruity
3-benzyl-4-heptanoneFL/FR
grassy
 tobacco leaf absoluteFL/FR
green
isocyclocitral (IFF)FL/FR
para-methyl hydratropaldehydeFL/FR
herbal
 angelica archangelica seed extractFL/FR
 dill seed oilFL/FR
 dill seed oil CO2 extractFL/FR
 immortelle flower oilFL/FR
 lavandin water absoluteFL/FR
 thyme oil wild or creepingFL/FR
medicinal
dextro-camphorFL/FR
minty
 pennyroyal oilFL/FR
musk
 angelica root absoluteFL/FR
nutty
 pentanoic acid, 3-methyl-2-oxo-, ethyl esterFL/FR
spicy
 cardamom seed oil CO2 extractFL/FR
 cinnamon acroleinFL/FR
 ginger oleoresin africaFL/FR
 ginger root absoluteFL/FR
 ginger root oil cochinFL/FR
 levisticum officinale herb oilFL/FR
 levisticum officinale root absoluteFL/FR
 levisticum officinale root tinctureFL/FR
2-octanolFL/FR
black pepper absoluteFL/FR
white pepper oilFL/FR
black pepper oilFL/FR
black pepper oleoresinFL/FR
para-isopropyl acetophenoneFL/FR
thujonic
common tansy flower oil argentinaFL/FR
woody
 cadineneFL/FR
alpha-pineneFL/FR
 
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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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