musk methyl ketone
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IUPAC name :1-(1,1,2,6-tetramethyl-3-propan-2-yl-2,3-dihydroinden-5-yl)ethanone
InChI :InChI=1/C18H26O/c1-10(2)17-12(4)18(6,7)16-8-11(3)14(13(5)19)9-15(16)17/h8-10,12,17H,1-7H3
InChIKey :IMRYETFJNLKUHK-UHFFFAOYAC
SMILES :CC1C(C2=C(C1(C)C)C=C(C(=C2)C(=O)C)C)C(C)C
cas number :68140-48-7
(EINECS) number :268-799-0
molar refractivity :81.17 ± 0.3 cm3
parachor :644.8 ± 6.0 cm3
index of refraction :1.498 ± 0.02
surface tension :29.4 ± 3.0 dyne/cm
density :0.933 ± 0.06 g/cm3
polarizability :32.17 ± 0.5 10-24cm3
XlogP : 6.20
XlogP3-AA : 5.10
molecular weight : 258.3984400 (IUPAC)
formula :C18 H26 O
NMR Predictor :Predict
 
 
export tariff code :2914.39.9000
fda reg :unspecified
Suppliers :
John D. Walsh :Traseolide 100
John D. Walsh :Traseolide 70
Vigon :TRASEOLIDE
organoleptics :
odor type :musk
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description¹ :
at 100.00 %.  		dry sweet amber musk herbal creamy
odor sample from :Quest International
substantivity :400  Hour(s)
properties :
appearence :pale yellow to yellow clear viscous liquid
assay : 96.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.97390 to 0.98400 @ 25.00 °C.
pounds per gallon - calc. : 8.104 to 8.188
refractive index :1.52800 to 1.53400 @ 20.00 °C.
boiling point : 178.00 °C. @ 5.00 mm Hg
vapor pressure :1.20000 mm/Hg @ 25.00 °C.
flash point :> 212.00  °F.  TCC  ( > 100.00 °C. )
logP (o/w) : 6.14
shelf life : 24.00 month(s) or longer if stored properly.
storage :store in cool, dry place in tightly sealed containers, protected from heat and light.
safety :
most important hazard(s) :Xi - Irritant
  R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 
safety in use :
 
recommendation for musk methyl ketone fragrance usage levels up to :
  25.0000 % in the fragrance concentrate.
recommendation for musk methyl ketone flavor usage levels up to :
 not for flavor use.
safety references :
msds :msds
EPI System :view
Chemical Carcinogenesis Research Information System :Search
Env. Mutagen Info. Center :Search
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
 
1-(1,1,2,6-tetramethyl-3-propan-2-yl-2,3-dihydroinden-5-yl)ethanone
(EINECS) number :268-799-0
chemidplus :068140487
EPA Substance Registry Services :68140-48-7
references :
 
1-(1,1,2,6-tetramethyl-3-propan-2-yl-2,3-dihydroinden-5-yl)ethanone
NIST Chemistry WebBook :68140487
pubchem :668501
Cosmetics :
Cosmetic uses : perfuming agents
other :
reference : Luebke, William tgsc, (1996)¹
CosIng :cosmetic data
 C of A
synonyms :
 acetyl isopropyl tetramethyl indane
5-acetyl-3-isopropyl-1,1,2,6-tetramethyl indane methyl ketone
1-(2,3-dihydro-1,1,2,6-tetramethyl-3-(1-methyl ethyl)-1H-inden-5-yl) ethan-1-one
 musk methyl ketone
3-isopropyl-1,1,2,6-tetramethyl-5-indanyl methyl ketone
1-(1,1,2,6-tetramethyl-3-(1-methyl ethyl)-2,3-dihydro-1H-5-indenyl)-1-ethanone
1-(1,1,2,6-tetramethyl-3-propan-2-yl-2,3-dihydroinden-5-yl)ethanone
 traseolide
soluble in :
 alcohol
 dipropylene glycol
 water, 0.085 mg/L @ 25C
insoluble in :
 water
stability :
 antiperspirant
 detergent
 soap
 acid cleaner
potential blenders :
 ambrette seed oilFL/FR
 ambroxanFL/FR
isoamyl benzoateFL/FR
alpha-amyl cinnamaldehydeFL/FR
isoamyl salicylateFL/FR
 amyris wood oilFR
 angelica root oilFL/FR
para-anisaldehydeFL/FR
para-anisyl acetateFL/FR
para-anisyl alcoholFL/FR
 benzoin resinoidFL/FR
 benzophenoneFL/FR
 benzyl benzoateFL/FR
 benzyl cinnamateFL/FR
 benzyl isoeugenolFL/FR
 benzyl salicylateFL/FR
 bois de rose oilFL/FR
isobutyl cinnamateFL/FR
 cedarwood oils 
 cinnamyl alcoholFL/FR
 cistus oilFL/FR
 citronellolFL/FR
 citrus carbaldehydeFR
 clary sage oilFL/FR
 coriander seed oilFL/FR
 costus root oilFL
 coumarinFR
 currant bud absolute blackFL/FR
 cyclamen aldehydeFL/FR
 cyclohexyl ethyl alcoholFL/FR
alpha-damasconeFL/FR
beta-damasconeFL/FR
 davana oilFL/FR
 decanalFL/FR
 decanolFL/FR
 dimethyl anthranilateFL/FR
 dimethyl benzyl carbinolFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 dodecanalFL/FR
 dodecanolFL/FR
 ethyl cinnamateFL/FR
 ethyl laurateFL/FR
 ethyl maltolFL/FR
 ethyl phenyl acetateFL/FR
 ethyl vanillinFL/FR
isoeugenyl acetateFL/FR
 fennel seed oilFL/FR
 floral pyranolFR
 frankincense oilFL/FR
 gardenia oxideFR
 guaiacwood oilFL/FR
 gurjun balsam oilFR
 hay absoluteFR
 heliotropinFL/FR
 heliotropyl diethyl acetalFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 hyacinth etherFR
 hydroxycitronellalFL/FR
 ionones 
 labdanum resinoidFR
 leerallFR
 lilyallFR
 linaloolFL/FR
laevo-linaloolFL/FR
 linalool oxideFL/FR
 linalyl acetateFL/FR
 methyl cedryl ketoneFL/FR
 methyl cinnamateFL/FR
 methyl dihydrojasmonateFL/FR
 methyl heptine carbonateFL/FR
 methyl ionones 
 methyl isoeugenolFL/FR
 methyl octine carbonateFL/FR
2-methyl undecanalFL/FR
 mimosa absoluteFL/FR
 muguet octadienolFR
 musks 
 myrrh oilFL/FR
beta-naphthyl ethyl etherFL/FR
gamma-nonalactoneFL/FR
 nonanalFL/FR
 nonanolFL/FR
 nutmeg oilFL/FR
 oakmoss absoluteFL/FR
 ocean propanalFL/FR
gamma-octalactoneFL/FR
 orris pyridineFL/FR
 osmanthus absoluteFL/FR
 patchouli ethanoneFR
 patchouli oilFL/FR
 peru balsam oilFL/FR
 phenethyl acetateFL/FR
 phenethyl alcoholFL/FR
 phenethyl phenyl acetateFL/FR
 phenyl acetic acidFL/FR
3-phenyl propionaldehydeFL/FR
3-phenyl propyl alcoholFL/FR
 raspberry ketoneFL/FR
 raspberry ketone acetateFL/FR
 raspberry ketone methyl etherFL/FR
 rhodinolFL/FR
 rose butanoateFL/FR
 rose oxides 
 sandalwood oilFL/FR
 santallFR
 tetrahydrolinaloolFL/FR
 tobacco absoluteFR
 tobacco dodecaneFR
 tonka bean absoluteFR
gamma-undecalactoneFL/FR
 undecanolFL/FR
10-undecen-1-alFL/FR
 vanilla absoluteFL/FR
 vanillyl acetateFL/FR
 verymossFR
 vetiver oilFL/FR
 violet leaf absoluteFL/FR
 violet methyl carbonateFR
 woody acetateFR
 woody amyleneFR
 woody propanolFR
potential uses :
 aldehydic
 alpine bouquet
 amber
 ambreine
 animal
 balsam
 beeswax cire d'abeille
 burberry
 cabreuva
 cascarilla
 cassia blossom
 cedar forest
 christmas blends
 chypre
 cinnamon
 civet
 clean
 cloth clean cloths
 cyclamen
 dahlia
 daisy
 daphne
 diffusion
 dillenia
 dogwood
 dusty
 enhancer
 fern fougere
 floral
 flouve blossom
 foliage
 forest
 ginger white ginger
 grass sweet grass
 guaiacwood
 hay new mown hay foin coupe
 heather
 herbal
 incense
 ivy leaf
 leather
 meadow
 moss
 musk
 myrrh
 new car
 ocean sea
 opoponax
 oriental
 patchouli
 pear prickly pear
 petunia
 phlox
 pinon cone
 powder
 privet blossom
 rain spring rain
 rose
 rose d'orient
 rose moss rose
 rose white rose
 sandalwood
 spice
 tobacco tabac tabaco
 tonka
 tulip
 vanilla
 woodruff asperula
 woody
natural occurrence in :
 not found in nature  


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