methyl cedryl ketone
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Notes :
Blends well with cedrenes.
 
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InChI :InChI=1/C17H26O/c1-10-6-7-15-16(4,5)14-9-17(10,15)8-13(11(14)2)12(3)18/h10,14-15H,6-9H2,1-5H3
InChIKey :YBUIAJZFOGJGLJ-UHFFFAOYAK
SMILES :CC1CCC2C13CC(C2(C)C)C(=C(C3)C(=O)C)C
cas number :32388-55-9
(EINECS) number :251-020-3
fl. number :07.143
molar refractivity :74.14 ± 0.4 cm3
parachor :594.2 ± 6.0 cm3
index of refraction :1.517 ± 0.03
surface tension :34.5 ± 5.0 dyne/cm
density :1.00 ± 0.1 g/cm3
polarizability :29.39 ± 0.5 10-24cm3
XlogP : 4.10
XlogP3-AA : 4.00
molecular weight : 246.3877400 (IUPAC)
formula :C17 H26 O
NMR Predictor :Predict
 
 
InChI :InChI=1/C17H28O/c1-11-6-7-13-15(3,4)14-10-17(11,13)9-8-16(14,5)12(2)18/h11,13-14H,6-10H2,1-5H3/t11-,13+,14-,16-,17u/m1/s1
InChIKey :ZSPIIBJQRZLFHP-WRHXGLHUBJ
SMILES :C[C@@H]1CC[C@@H]2C13CC[C@]([C@H](C3)C2(C)C)(C)C(=O)C
cas number :73398-84-2
molar refractivity :74.70 ± 0.4 cm3
parachor :610.3 ± 6.0 cm3
index of refraction :1.503 ± 0.03
surface tension :34.1 ± 5.0 dyne/cm
density :0.98 ± 0.1 g/cm3
polarizability :29.61 ± 0.5 10-24cm3
XlogP : 4.70
XlogP3-AA : 4.70
molecular weight : 248.4036200 (IUPAC)
formula :C17 H28 O
NMR Predictor :Predict
 
 
export tariff code :2914.29.0090
fda reg :unspecified
Suppliers :
Berje :Methyl Cedryl Ketone
Fleurchem :methyl cedryl ketone
IFF :Methyl Cedryl Ketone Chinese
Odor:  Warm, woody, cedarwood, resinous note with musk undertones.
IFF :Vertofix® Coeur
Odor:  A warm precious wood aroma with musky undertones. Long lasting and diffusive. Woody, cedar, leathery, dry.
John D. Walsh :Methyl Cedryl Ketone
Moellhausen :methyl cedryl ketone
85% min. nature identical kosher
Polarome :METHYL CEDRYL KETONE COEUR
Polarome :METHYL CEDRYL KETONE TEXAS
Polarome :METHYL CEDRYL KETONE
Polarome :METHYL CEDRYL KETONE
BLEND
Shanghai Green Leaf :Methyl cedryl ketone
(MCK)
Sigma-Aldrich-SAFC :Methyl cedryl ketone
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organoleptics :
odor type :woody
odor strength :medium
odor description¹ :
at 100.00 %.  		woody vetiver amber leather musk cedar
odor sample from :International Flavors & Fragrances Inc.
substantivity :400  Hour(s)
properties :
appearence :yellow to brown clear oily liquid
assay : 96.00 to 100.00 %   sum of isomers
Food Chemicals Codex Listed :No
specific gravity :1.00000 to 1.01000 @ 25.00 °C.
pounds per gallon - calc. : 8.321 to 8.404
specific gravity :1.00100 to 1.01100 @ 20.00 °C.
pounds per gallon - calc. : 8.339 to 8.422
refractive index :1.51700 to 1.52400 @ 20.00 °C.
boiling point : 272.00 °C. @ 760.00 mm Hg
acid value : 2.00  max.  KOH/g
flash point : 212.00  °F.  TCC  ( 100.00 °C. )
logP (o/w) : 5.66
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 :
Category :flavor and fragrance agents
 
recommendation for methyl cedryl ketone fragrance usage levels up to :
  10.0000 % in the fragrance concentrate.
safety references :
msds :msds
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
(EINECS) number :251-020-3
chemidplus :068039350
EPA Substance Registry Services :32388-55-9
 
 
chemidplus :073398842
EPA Substance Registry Services :73398-84-2
references :
fl. number :07.143
pubchem :684266
pubchem :752690
Cosmetics :
Cosmetic uses : perfuming agents
other :
reference : Luebke, William tgsc, (1994)¹
CosIng :cosmetic data
 C of A
RIFM :listed
FMA :listed
synonyms :
9-acetyl cedr-8-ene
 acetyl cedrene
9-acetyl-8-cedrene
 acetyl-alpha-cedrene
1-cedr-8-en-9-yl ethanone
 cedr-8-enyl methyl ketone
 cedryl methyl ketone
 cedrylide
(3R- (3alpha,3a,7,8aalpha))- 1-(2,3,4,7,8,8a-hexahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-5-yl) ethan-1-one
 lignofix
 lixetone
 methyl cedryl ketone
(3R-(3alpha,3abeta, 6beta,7beta,8aalpha))-1-(octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-yl) ethanone
1-((3R,3aS,6S,7R,8aS)-octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-yl) ethanone
1-(2,6,8,8-tetramethyl tricyclo(5.3.1.01,5)undec-8-en-9-yl)-1-ethanone
 vertofix
 woodyflor
soluble in :
 alcohol
 paraffin oil
insoluble in :
 water
stability :
 acid cleaner
 alcoholic lotion
 deo stick
 detergent perborate
 fabric softener
 hard surface cleaner
 liquid detergent
 shampoo
 soap
potential blenders :    note
 acetophenoneFL/FR
 allyl iononeFL/FR
 amber carbinolFR
 amber oxepinFR
 ambrette seed oilFL/FR
 ambroxanFL/FR
alpha-amyl cinnamaldehydeFL/FR
isoamyl salicylateFL/FR
 amyris wood oilFL/FR
 angelica root oilFL/FR
para-anisaldehydeFL/FR
para-anisyl alcoholFL/FR
 armoise oilFR
 bay leaf oilFL/FR
 benzoin resinoidFL/FR
 benzophenoneFL/FR
 benzyl benzoateFL/FR
 benzyl isoeugenolFL/FR
 benzyl salicylateFL/FR
 bergamot oilFL/FR
 bois de rose oilFL/FR
isobornyl acetateFL/FR
laevo-bornyl acetateFL/FR
isobutyl benzoateFL/FR
isobutyl cinnamateFL/FR
isobutyl quinolineFR
isobutyl salicylateFL/FR
 caraway seed oilFL/FR
 carrot seed oilFL/FR
 cassia bark oilFL/FR
 cedarleaf oilFL/FR
 cedarwood oils 
 cedrenes 
 cedryl methyl etherFR
 cinnamyl alcoholFL/FR
 cistus oilFL/FR
 citronellolFL/FR
 clary sage oilFL/FR
 clove bud oilFL/FR
 coconut absoluteFL/FR
 coriander seed oilFL/FR
 costus valerolactoneFR
 coumarinFR
 cyclamen aldehydeFL/FR
 cypress oilFR
 decanolFL/FR
 dimethyl benzyl carbinolFL/FR
 dimethyl benzyl carbinyl acetateFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 diphenyl oxideFL/FR
 dodecanalFL/FR
 dodecanolFL/FR
 ethyl cinnamateFL/FR
4-ethyl guaiacolFL/FR
 ethyl laurateFL/FR
 ethyl phenyl acetateFL/FR
 ethyl vanillinFL/FR
 eugenolFL/FR
isoeugenyl acetateFL/FR
 fir balsam absoluteFR
 floral pyranolFR
 frankincense resinoidFL/FR
 fruity cyclopentanoneFR
 galbanum oxathianeFL/FR
 gardenia decaloneFR
 guaiacwood oilFL/FR
 gurjun balsam oilFR
 hay absoluteFR
 heliotropinFL/FR
 heliotropyl acetoneFL/FR
 heliotropyl diethyl acetalFR
gamma-heptalactoneFL/FR
gamma-hexalactoneFL/FR
(Z)-3-hexen-1-yl benzoateFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 ho leaf oilFR
 hyacinth etherFR
 hydroxycitronellalFL/FR
 ionones 
 irones 
 labdanum resinoidFR
 leerallFR
 linaloolFL/FR
laevo-linaloolFL/FR
 linalool oxideFL/FR
 linalyl acetateFL/FR
 mastic resinFR
 methyl acetophenoneFL/FR
alpha-methyl cinnamaldehydeFL/FR
 methyl cinnamateFL/FR
 methyl dihydrojasmonateFL/FR
 methyl ionones 
 methyl isoeugenolFL/FR
2-methyl undecanalFL/FR
 methyl undecylenateFL/FR
 muguet carboxaldehydeFR
 musks 
 myrrh oilFL/FR
beta-naphthyl ethyl etherFL/FR
 nerolidolFL/FR
gamma-nonalactoneFL/FR
 nopyl acetateFR
 ocean propanalFL/FR
 orris pyridineFR
 patchouli ethanoneFR
 patchouli oilFL/FR
 phenethyl alcoholFL/FR
 phenethyl phenyl acetateFL/FR
 phenethyl salicylateFL/FR
 phenyl acetaldehyde dimethyl acetalFL/FR
3-phenyl propionaldehydeFL/FR
3-phenyl propyl alcoholFL/FR
isopropyl ionone 
 raspberry ketoneFL/FR
 rhodinolFL/FR
 rose butanoateFL/FR
 sage oilFL/FR
 santallFR
 spruce oilFL/FR
alpha-terpineolFL/FR
 tetrahydrolinaloolFL/FR
 tobacco dodecaneFR
 tonka bean absoluteFR
 vanilla absoluteFL/FR
 vanillyl acetateFL/FR
 verymossFR
 vetiver oilFL/FR
 woody acetateFR
 woody amyleneFR
 woody propanolFR
potential uses :
 alliage
 amber
 anais anais
 angel
 animal
 antaeus
 azzaro
 balsam
 cedar
 cerruti
 charlie
 cloth clean cloths
 devin
 diffusion
 estee
 fidji
 halston
 herbal
 incense
 j' ai ose
 leather
 marbert man
 moss
 musk
 oriental
 patchouli
 polo
 rain
 sandalwood
 tide
 turbulences
 vetiver
 woody
natural occurrence in :    note
 not found in nature  


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