(E,E)-farnesol
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol
InChI :InChI=1/C15H26O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,11,16H,5-6,8,10,12H2,1-4H3/b14-9+,15-11+
InChIKey :CRDAMVZIKSXKFV-YFVJMOTDBO
SMILES :CC(=CCC/C(=C/CC/C(=C/CO)/C)/C)C
cas number :106-28-5
fema number :2478
molar refractivity :72.77 ± 0.3 cm3
parachor :595.8 ± 4.0 cm3
index of refraction :1.485 ± 0.02
surface tension :30.3 ± 3.0 dyne/cm
density :0.875 ± 0.06 g/cm3
polarizability :28.85 ± 0.5 10-24cm3
xlogp : 3.10
molecular weight : 222.3663400
formula :C15 H26 O
BioActivity Analysis :108589
 
 
export tariff code :2905.22.0000
fda reg :unspecified
 

Suppliers :
Bedoukian Research :(e,e)-FARNESOL
≥97.0% (sum of isomers), FCC, Kosher

organoleptics :
odor type :floral
odor strength :low
odor description :
at 100.00 %.  
mild muguet floral sweet lily waxy

properties :
appearence :colorless clear liquid
assay : 97.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.87900 @ 25.00 °C.
refractive index :1.49000 @ 20.00 °C.
boiling point : 283.00 to 284.00 °C. @ 760.00 mm Hg
logp : 5.31

safety :
Oral Toxicity(LD50) : Oral-Rat    6.00  gm/kg  THERAP  27,893,1972
Dermal Toxicity(LD50) : Not determined
flash point ( Deg. F. ) : 205.00  °F.  TCC  ( 96.11 °C. )
IFRA critical Effect :Sensitization
Fragrance usage is RESTRICTED to :
Please review all IFRA documents for complete information. (QRA)
IFRA categories : limits in the finished product: (For a description of the categories, refer to the IFRA QRA Information Booklet.)
Category 1 :0.08 % (1)Category 2 :0.11 %
Category 3 :0.40 %Category 4 :1.20 %
Category 5 :0.60 %Category 6 :2.00 % (1)
Category 7 :0.20 %Category 8 :2.00 %
Category 9 :5.00 %Category 10 :2.50 %
Category 11 :See Note 
 

(1) IFRA would recommend that any material used to impart perfume or flavour in products intended for human ingestion should consist of ingredients that are in compliance with appropriate regulations for foods and food flavourings in the countries of planned distribution and, where these are lacking, with the recommendations laid down in the Code of Practice of IOFI (International Organisation of the Flavor Industry). Further information about IOFI can be found on its website (www.iofi.org).

 

Note : Category 11 includes all non-skin contact or incidental skin contact products. Due to negligible skin contact, the concentration of a fragrance ingredient should not exceed the usual concentration of the fragrance compound in the finished product.

For example, hypothetically if the usual concentration of a fragrance compound in the final product, for example a candle, is at 5%, then any individual fragrance ingredient (in this case (E,E)-farnesol) must not exceed 5% in the candle.

recommendation for (E,E)-farnesol usage levels up to :
  2.0000 ppm in the flavor.

safety references :
EPI System :view
 
 
 (2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol
RTECS :JR4979000 for 106-28-5
chemidplus :000106285
EPA Substance Registry Services :106-28-5
NLM Chemical Carcinogenesis Research Information System :106-28-5
NLM Developmental and Reproductive Toxicity :106-28-5
NLM Env. Mutagen Info. Center :106-28-5
NLM GENetic TOXicology :106-28-5
dtp/nci :60597

references :
 (2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol
pubchem :208109
NIST Chemistry WebBook :1055903602

other :
synonyms :
2,6-di-trans-farnesol
(E,E)-farnesol
(E,E)-2,6-farnesol
(E)-farnesol
2-trans,6-trans-farnesol
trans,trans-farnesol
(E,E)-3,7,11-trimethyl-2,6,10-dodecatrien-1-ol
trans,trans-3,7,11-trimethyl-2,6,10-dodecatrien-1-ol

soluble in :
 alcohol

insoluble in :
 water

(odor and/or flavor) blends with :
alpha-amyl cinnamaldehyde dimethyl acetal
 benzyl anthranilate
alpha-butyl cinnamaldehyde
 citronellyl ethoxalate
 citronellyl nitrile
 citronellyl oxyacetaldehyde
 citrus ocimenol
para-cresyl isobutyrate
para-cresyl phenyl acetate
para-cresyl propionaldehyde
 cumin carbinol
 cyclamen aldehyde / methyl anthranilate schiff's base
 cyclamen homoaldehyde
 cyclohexyl ethyl alcohol
 cyclohexyl propanol
2-decalinol
(Z)-4-decen-1-al
9-decen-1-al
 dimethyl benzyl carbinyl formate
 ethyl laurate
 ethyl linalyl acetal
 floral butanal
 floral pyranol
 freesia acetate
 gardenia decalone
 hawthorn ethanol
 heptyl formate
 hexadecanol
 hexyl 2-furoate
 hydroxycitronellal
 hydroxycitronellal / methyl anthranilate schiff's base
 hydroxycitronellal diethyl acetal
 hydroxycitronellal dimethyl acetal
 hydroxycitronellol
 jasimia
 leerall
 leerall / methyl anthranilate schiff's base
 lily pentanal
 lily propanol
 lilyall
 lilyall / methyl anthranilate schiff's base
 linalyl benzoate
 linalyl cinnamate
 linalyl propionate
 magnolia cyclohexanol
 magnolia decadienal
 mandarine undecenal
 methoxycitronellal
 methyl citronellate
 methyl heptanoate
2-methyl octanal
 muguet butanal
 muguet butanol
 muguet carbaldehyde
 muguet carbinol
 muguet carboxaldehyde
 muguet ethanol
 muguet nitrile
 muguet octadienol
 muguet propanol
 muguet shiseol
 muguet undecadienal
 myrmac aldehyde
(Z)-nerolidol
 nonanal
3-nonanon-1-yl acetate
 ozone propanal
 phenethyl hexanoate
 phenyl glycol diacetate
alpha-terpinyl anthranilate
 tetrahydrolinalool
 tetrahydromyrcenol
(Z)-8-undecen-1-al
10-undecen-1-ol
 waxy aldehyde
 ylang ylang oil

(odor and/or flavor) used in :
 aldehydic
 floral
 lily
 muguet lily of the valley
 waxy

natural occurrence in :
data pageambrette seed concrete @ 2.16%
data pageboronia absolute @ 0.08%
data pagecabocla flower oil brazil @ 0.50%
data pagechampaca concrete @ 0.20%
data pageclove bud oil @ 1.08%
data pageclove leaf oil @ 0.61%
data pageclove stem oil india @ 0.69%
data pagecouroupita guianensis aubl. flower oil brazil @ 16.10%
data pagecurry fruit oil india @ <0.05%
data pagecurry leaf oil india @ 0.20%
data pagegeranium rose-scented oil (pelargonium spp.) cuba @ 0.20%
data pageginger root oil CO2 extract @ 0.88%
data pageguava leaf oil cuba @ 0.20%
data pagejasmin sambac absolute egypt @ 1.30%
data pagepalmarosa oil @ 1.90%
data pagerose oil otto bulgaria @ 1.98%
data pageskimmia laureola oil @ 0.7%
data pagethevetia peruviana (pers.) k. schum. flower oil brazil @ 0.10%
data pageylang ylang oil @ 0.84%
data pageylang ylang oil CO2 extract @ 1.39%



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