methyl cedryl ketone
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Notes :
Blends well with cedrenes.
 
Right Click Jmol Molecule For More Options. (Safari 1.2 (v125) Compatible). Jmol is a free download found Here.
 
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) (PT) (112)
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) (PT) (112)
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
Global Essence :METHYL CEDRYL KETONE
IFF :Methyl Cedryl Ketone Chinese
Odor:  Woody, Leather, Vetivert
Warm, woody, cedarwood, resinous note with musk undertones. Long lasting.
IFF :Vertofix® Coeur
Odor:  Woody, Vetivert, Leather
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
SAFC Global® :Methyl cedryl ketone
Sensient Fragrances :Methyl Cedryl Ketone
Shanghai Green Leaf :Methyl cedryl ketone
(MCK)

organoleptics :
odor type :woody
odor strength :medium
odor description:
at 100.00 %.  
woody vetiver amber leather musk cedar
Luebke, William tgsc, (1994)
odor sample from :International Flavors & Fragrances Inc.
substantivity :400  Hour(s)

properties :
appearence :yellow to brown clear oily liquid
Food Chemicals Codex Listed :No
specific gravity :1.01000 @ 0.00 °C.
refractive index :1.52100 @ 0.00 °C.
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 :
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
 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 resinoid siamFL/FR
 benzophenoneFL/FR
 benzyl benzoateFL/FR
 benzyl isoeugenolFL/FR
 benzyl salicylateFL/FR
 bergamot oil bergaptene reduced italyFL/FR
 bois de rose oil brazilFL/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 oil chinaFL/FR
 cedarleaf oilFL/FR
 cedryl methyl etherFR
 cinnamyl alcoholFL/FR
 cistus oilFL/FR
 citronellolFL/FR
 clary sage oil franceFL/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
 dodecanal (aldehyde C-12 lauric)FL/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
(Z)-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
 labdanum resinoidFR
 leerallFR
 linaloolFL/FR
laevo-linaloolFL/FR
 linalool oxideFL/FR
 linalyl acetateFL/FR
 mastic gum resinFR
 methyl (E)-cinnamateFL/FR
para-methyl acetophenoneFL/FR
alpha-methyl cinnamaldehydeFL/FR
 methyl dihydrojasmonateFL/FR
 methyl isoeugenolFL/FR
2-methyl undecanal (aldehyde C-12 mna)FL/FR
 methyl undecylenateFL/FR
 muguet carboxaldehydeFR
 myrrh oilFL/FR
beta-naphthyl ethyl etherFL/FR
 nerolidolFL/FR
gamma-nonalactone (aldehyde C-18)FL/FR
 nopyl acetateFR
 ocean propanalFL/FR
 orris pyridine 25% ipmFR
 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
 raspberry ketoneFL/FR
 rhodinolFL/FR
 rose butanoateFL/FR
 sage oil dalmatianFL/FR
 santallFR
 spruce oil canadaFL/FR
alpha-terpineolFL/FR
 tetrahydrolinaloolFL/FR
 tobacco dodecaneFR
 tonka bean absoluteFR
 tropical iononeFL/FR
 vanilla absolute 100%FL/FR
 vanillyl acetateFL/FR
 verymossFR
 vetiver oil haitiFL/FR
 woody acetateFR
 woody amyleneFR
 woody propanolFR

potential uses :
 alliage 
 amberFR
 anais anais 
 angel 
 animalFR
 antaeus 
 azzaro 
 balsamFR
 cedarFR
 cerruti 
 charlie 
 cloth clean cloths 
 devin 
 diffusion 
 estee 
 fidji 
 halston 
 herbalFR
 incenseFR
 j' ai ose 
 leatherFR
 marbert man 
 muskFR
 oakmoss mousse de chene mossFR
 orientalFR
 patchouliFR
 polo 
 rainFR
 sandalwoodFR
 tide 
 turbulences 
 vetiverFR
 woodyFR

natural occurrence in :    note
 not found in nature  



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