oakmoss phenol
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IUPAC name :3-methoxy-5-methylphenol
InChI :InChI=1/C8H10O2/c1-6-3-7(9)5-8(4-6)10-2/h3-5,9H,1-2H3
InChIKey :NOTCZLKDULMKBR-UHFFFAOYAR
SMILES :CC1=CC(=CC(=C1)OC)O
cas number :3209-13-0
(EINECS) number :221-716-1
molar refractivity :39.63 ± 0.3 cm3
parachor :316.6 ± 4.0 cm3
index of refraction :1.530 ± 0.02
surface tension :37.2 ± 3.0 dyne/cm
density :1.078 ± 0.06 g/cm3
polarizability :15.71 ± 0.5 10-24cm3
XlogP : 2.00
molecular weight : 138.1638000 (IUPAC)
formula :C8 H10 O2
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified

Suppliers :
Givaudan :Orcinyl 3
Odor:  Oakmoss, Sweet, Phenolic
Vigon :Orcinyl-3
Odor:  FRUITY, OAKMOSS

organoleptics :
odor type :mossy
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description :¹
at 10.00 % in dipropylene glycol.  
oakmoss fruity iodine woody hay
odor sample from :Roure Bertrand Dupont Inc.
substantivity :400  Hour(s)

properties :
appearence :white to tan powder
assay : 98.00 to 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 254.00 to 255.00 °C. @ 760.00 mm Hg
flash point : 275.00  °F.  TCC  ( 135.00 °C. )
logP (o/w) : 1.98

safety :
most important hazard(s) :Xn - Harmful.
  R 22 - Harmful if swallowed.
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 37/39 - Wear suitable gloves and eye/face protection.
Oral Toxicity(LD50) :
  Oral-Rat    1500.00  mg/kg

Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 

safety in use :
 
recommendation for oakmoss phenol usage levels up to :
  1.0000 % in the fragrance concentrate.
recommendation for oakmoss phenol usage levels up to :
 not for flavor use.

safety references :
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :3
 
 
 
 3-methoxy-5-methylphenol
(EINECS) number :221-716-1
chemidplus :003209130
EPA Substance Registry Services :3209-13-0

references :
 3-methoxy-5-methylphenol
pubchem :653747

Cosmetics :
Cosmetic uses : perfuming agents

other :
reference : Luebke, William tgsc, (1985)¹
CosIng :cosmetic data
synonyms :
3-hydroxy-5-methoxytoluene
3-methoxy-5-methyl phenol
3-methoxy-5-methylphenol
5-methoxy-meta-cresol
 orcinyl

soluble in :
 alcohol
 water, 7862 mg/L @ 20C

insoluble in :
 water

(odor and/or flavor) blends with :
 acorn acetate
 algae absolute
 boronia butenal
4-tert-butyl phenol
isobutyl quinoline
 caryophyllene alcohol
beta-caryophyllene alcohol
 citrus carbaldehyde
 decanal diethyl acetal
3-ethyl pyridine
 floral nitrile
 genet concrete
 hay absolute
(E)-2-hexen-1-yl phenyl acetate
 lime octenol
 longiborneol
 lovage root oil
 marine decadienal
 marine hexane
 marine nitrile
 mate absolute
 methyl delta-ionone
2-methyl undecanal
 muguet carboxaldehyde
 oakmoss absolute
 ocean carboxaldehyde
 orange nitrile
(+)-beta-pinene
 rhubarb pyran
 sea resorcylate
 tetrahydromyrcenyl acetate
 tobacco leaf absolute
 verymoss

(odor and/or flavor) used in :
 amber
 hay new mown hay foin coupe
 moss
 oakmoss mousse de chene
 ocean sea
 oriental
 topnotes
 woody

natural occurrence in :
not found in nature



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