galbanum decatriene
Suppliers  Organoleptics  properties  safety  references  cosmetics    FEMA Index    Home Page
 
Right Click Jmol Molecule For More Options. (Safari 1.2 (v125) Compatible). Jmol is a free download found Here.
 
IUPAC Name - undeca-1,3,5-triene
InChI - InChI=1/C11H18/c1-3-5-7-9-11-10-8-6-4-2/h3,5,7,9,11H,1,4,6,8,10H2,2H3
InChIKey - JQQDKNVOSLONRS-UHFFFAOYAO
SMILES - CCCCCC=CC=CC=C
CAS Number : 16356-11-9
(EINECS) Number :240-416-1
FEMA Number :3795
Molar Refractivity :52.85 ± 0.3 cm3 (est)
Parachor :433.2 ± 4.0 cm3 (est)
Index of Refraction :1.461 ± 0.02 (est)
Surface Tension :25.6 ± 3.0 dyne/cm (est)
Density :0.780 ± 0.06 g/cm3 (est)
Polarizability :20.95 ± 0.5 10-24cm3 (est)
XlogP : 4.10 (est)
Molecular Weight : 150.2606200 (IUPAC) (PT) (112)
Formula :C11 H18
NMR Predictor :Predict
 
 
IUPAC Name - (3E,5E)-undeca-1,3,5-triene
InChI - InChI=1/C11H18/c1-3-5-7-9-11-10-8-6-4-2/h3,5,7,9,11H,1,4,6,8,10H2,2H3/b7-5+,11-9+
InChIKey - JQQDKNVOSLONRS-JEGFTUTRBA
SMILES - CCCCC\C=C\C=C\C=C
CAS Number : 19883-29-5
(EINECS) Number :243-398-3
Molar Refractivity :52.85 ± 0.3 cm3 (est)
Parachor :433.2 ± 4.0 cm3 (est)
Index of Refraction :1.461 ± 0.02 (est)
Surface Tension :25.6 ± 3.0 dyne/cm (est)
Density :0.780 ± 0.06 g/cm3 (est)
Polarizability :20.95 ± 0.5 10-24cm3 (est)
XlogP : 4.10 (est)
Molecular Weight : 150.2606200 (IUPAC) (PT) (112)
Formula :C11 H18
NMR Predictor :Predict
 
 
IUPAC Name - (3E,5Z)-undeca-1,3,5-triene
InChI - InChI=1/C11H18/c1-3-5-7-9-11-10-8-6-4-2/h3,5,7,9,11H,1,4,6,8,10H2,2H3/b7-5+,11-9-
InChIKey - JQQDKNVOSLONRS-STRRHFTIBR
SMILES - CCCCC\C=C/C=C/C=C
CAS Number : 51447-08-6
(EINECS) Number :257-214-4
Molar Refractivity :52.85 ± 0.3 cm3 (est)
Parachor :433.2 ± 4.0 cm3 (est)
Index of Refraction :1.461 ± 0.02 (est)
Surface Tension :25.6 ± 3.0 dyne/cm (est)
Density :0.780 ± 0.06 g/cm3 (est)
Polarizability :20.95 ± 0.5 10-24cm3 (est)
XlogP : 4.10 (est)
Molecular Weight : 150.2606200 (IUPAC) (PT) (112)
Formula :C11 H18
NMR Predictor :Predict
 
 
IUPAC Name - (3Z,5E)-undeca-1,3,5-triene
InChI - InChI=1/C11H18/c1-3-5-7-9-11-10-8-6-4-2/h3,5,7,9,11H,1,4,6,8,10H2,2H3/b7-5-,11-9+
InChIKey - JQQDKNVOSLONRS-BABZSUFTBY
SMILES - CCCCC\C=C\C=C/C=C
CAS Number : 19883-27-3
(EINECS) Number :243-397-8
Molar Refractivity :52.85 ± 0.3 cm3 (est)
Parachor :433.2 ± 4.0 cm3 (est)
Index of Refraction :1.461 ± 0.02 (est)
Surface Tension :25.6 ± 3.0 dyne/cm (est)
Density :0.780 ± 0.06 g/cm3 (est)
Polarizability :20.95 ± 0.5 10-24cm3 (est)
XlogP : 4.10 (est)
Molecular Weight : 150.2606200 (IUPAC) (PT) (112)
Formula :C11 H18
NMR Predictor :Predict
 
 
IUPAC Name - (3Z,5Z)-undeca-1,3,5-triene
InChI - InChI=1/C11H18/c1-3-5-7-9-11-10-8-6-4-2/h3,5,7,9,11H,1,4,6,8,10H2,2H3/b7-5-,11-9-
InChIKey - JQQDKNVOSLONRS-CXHWBCNXBQ
SMILES - CCCCC\C=C/C=C\C=C
CAS Number : 19883-26-2
(EINECS) Number :243-396-2
Molar Refractivity :52.85 ± 0.3 cm3 (est)
Parachor :433.2 ± 4.0 cm3 (est)
Index of Refraction :1.461 ± 0.02 (est)
Surface Tension :25.6 ± 3.0 dyne/cm (est)
Density :0.780 ± 0.06 g/cm3 (est)
Polarizability :20.95 ± 0.5 10-24cm3 (est)
XlogP : 4.10 (est)
Molecular Weight : 150.2606200 (IUPAC) (PT) (112)
Formula :C11 H18
NMR Predictor :Predict
 
 
Category :flavor and fragrance agents
EU / EUROPA / FDA / JECFA Information :
JECFA Food Flavoring : 1341
Fl@vouring Number : 01.061
FDA Mainterm : 1,3,5-UNDECATRIENE.
Suppliers :
Bedoukian Research :1,3,5-UNDECATRIENE
≥96.0% (sum of isomers), FCC, Kosher
Odor:  fresh green, resinous, galbanum, green pepper
Used where galbanum notes are needed in fragrances.
Flavor:  green
Used in cucumber, meat, chicken and bell pepper compositions.
Bedoukian Research :UNDECATRIENE
≥97.0%, Kosher
Odor:  galbanum-like
Berje :Undecatriene
Firmenich :Galbanolene Super
Odor:  An extremely powerful and diffusive material that is the key of galbanum
Normally used as a 10% solution, it will give personality and lift to many fragrance types whenever a unique green note is desired.
Givaudan :Undecatriene
10%/TEC
Odor:  Intense, Galbanum, Green, Herbaceous
Undecatriene is used in traces to provide a natural galbanum-like effect in compositions. It rounds out the palette of available green notes.
Penta :1,3,5-undecatriene
SAFC Global® :1,3,5-Undecatriene
≥70%, Kosher, Mixture of 1,3(E),5(Z) and 1,3(E),5(E) isomers
Odor:  pineapple; green
Organoleptics :
Odor Type :green
Odor Strength :high ,
recommend smelling in a 1.00 % solution or less
Odor Description:
at 1.00 % in dipropylene glycol.  		fresh green greasy resin galbanum green pepper
Luebke, William tgsc, (1994)
Odor sample from :Firmenich & Company Inc.
Odor Description:
Fresh green, cucumber, waxy, melon and vegetative, citrus
Mosciano, Gerard P&F 18, No. 5, 39, (1993)
Taste Description:
Green, vegetative, waxy, cucumber, chicken, fatty and fried notes
Mosciano, Gerard P&F 18, No. 5, 39, (1993)
Substantivity :104  Hour(s)
Properties :
Appearence :colorless clear oily liquid
Assay : 94.00 to 100.00 %   sum of isomers
Food Chemicals Codex Listed :No
Specific Gravity :0.78800 to 0.79600 @ 25.00 °C.
Pounds per Gallon - est. : 6.557 to 6.624
Refractive Index :1.51000 to 1.51800 @ 20.00 °C.
Boiling Point : 280.00 to 285.00 °C. @ 760.00 mm Hg
Boiling Point : 88.00 °C. @ 1.00 mm Hg
Vapor Pressure :0.10000 mm/Hg @ 20.00 °C.
Vapor Density :>1 ( Air = 1 )
Flash Point : 176.00  °F.  TCC  ( 80.00 °C. )
logP (o/w) : 5.05
Safety :
Most important hazard(s) :Xn N - Harmful, Dangerous for the environment.
  R 50/53 - Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
R 65 - Harmful: may cause lung damage if swallowed.
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 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
S 61 - Avoid release to the environment. Refer to special instructions/safety data sheet.
S 62 - If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label.
Oral Toxicity(LD50) : 
  Oral-Rat   [sex: M,F]  >8000.00  mg/kg
(Pellmont, 1973c)

Oral-Mouse   [sex: M,F]  2000.00 - 4000.00  mg/kg
(Pellmont, 1973c)

Dermal Toxicity(LD50) : 
  Skin-Rabbit  >3000.00  mg/kg

Inhalation Toxicity(LC50) : 
  Not determined
 
Safety in Use :
Category :flavor and fragrance agents
Maximised Survey-derived Daily Intakes (MSDI-EU) :0.17 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA) :0.20 (μg/capita/day)
Structure Class :I
 
Recommendation for galbanum decatriene fragrance usage levels up to :
  1.0000 % in the fragrance concentrate.
Recommendation for galbanum decatriene flavor usage levels up to :
  20.0000 ppm in the flavor.
Safety References :
European Food Safety Athority(efsa) :Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
 
undeca-1,3,5-triene
(EINECS) Number :240-416-1
Chemidplus :016356119
EPA Substance Registry Services :16356-11-9
RTECS :YQ2833000 for cas# 16356-11-9
 
 
 
(3E,5E)-undeca-1,3,5-triene
(EINECS) Number :243-398-3
Chemidplus :019883295
EPA Substance Registry Services :19883-29-5
 
 
 
(3E,5Z)-undeca-1,3,5-triene
(EINECS) Number :257-214-4
Chemidplus :019883273
EPA Substance Registry Services :51447-08-6
 
 
 
(3Z,5E)-undeca-1,3,5-triene
(EINECS) Number :243-397-8
Chemidplus :19883-27-3
EPA Substance Registry Services :19883-27-3
 
 
 
(3Z,5Z)-undeca-1,3,5-triene
(EINECS) Number :243-396-2
Chemidplus :019883262
EPA Substance Registry Services :19883-26-2
References :
 
undeca-1,3,5-triene
NIST Chemistry WebBook :1750883768
Pubchem :198226
 
(3E,5E)-undeca-1,3,5-triene
NIST Chemistry WebBook :3501126124
Pubchem :665100
 
(3E,5Z)-undeca-1,3,5-triene
NIST Chemistry WebBook :1903603954
Pubchem :665099
 
(3Z,5E)-undeca-1,3,5-triene
NIST Chemistry WebBook :1606227313
Pubchem :10512566
 
(3Z,5Z)-undeca-1,3,5-triene
Pubchem :665098
Cosmetics :
Cosmetic Uses : perfuming agents
Other :
CosIng :cosmetic data
FDA Everything Added to Food in the United States (EAFUS)View
Export Tariff Code :2901.29.6000
FMA :listed
RIFM :listed
VCF-Online: VCF Volatile Compounds in Food
Synonyms :
 galbanolene super
 galbanum decatriene
 undeca-1,3,5-triene
1,3,5-undecatriene
Soluble in :
 alcohol
Insoluble in :
 water
Stability :
 antiperspirant spray, poor
 candle, poor
 cream
 detergent powder, good
 liquid bleach, poor
 ph = 10, poor
 ph = 2, poor
 shampoo
 soap, good
Potential Blenders :    note
 abies alba needle oilFL/FR
 acetaldehyde ethyl phenethyl acetalFL/FR
 algae absolute greenFL/FR
 allyl amyl glycolateFR
 ambroxanFL/FR
isoamyl benzoateFL/FR
 amyris wood oilFL/FR
 animal carbolactoneFR
 anise seed oilFL/FR
para-anisyl alcoholFL/FR
 basil oil sweetFL/FR
 bay leaf oilFL/FR
 benzoin resinoid siamFL/FR
 benzyl alcoholFL/FR
 benzyl benzoateFL/FR
 benzyl salicylateFL/FR
 bois de rose oil brazilFL/FR
 camphor tree bark oilFL/FR
 caraway seed oilFL/FR
 carrot seed oilFL/FR
 cedarleaf oilFL/FR
 cinnamyl alcoholFL/FR
 cistus oilFL/FR
 citronellyl acetateFL/FR
 citrus carbaldehydeFR
 clary sage oil franceFL/FR
 clover nitrileFR
 cognac oil greenFL/FR
 cortex pyridineFL/FR
 costus root oilFL
 costus valerolactoneFR
para-cresyl caprylateFL/FR
 cubeb oilFL/FR
 cumin seed oilFL/FR
 cuminaldehydeFL/FR
 cyclamen aldehydeFL/FR
 cyclohexyl ethyl alcoholFL/FR
gamma-decalactoneFL/FR
 decanal (aldehyde C-10)FL/FR
 decyl acetateFL/FR
 dihydromyrcenolFL/FR
para-dimethyl hydroquinoneFL/FR
 dodecanal (aldehyde C-12 lauric)FL/FR
 dodecanolFL/FR
 ethyl laurateFL/FR
 fir balsam absoluteFR
 fir needle oil siberiaFL/FR
 floral pyranolFR
 flouve absoluteFR
 frankincense oilFL/FR
 geranyl acetateFL/FR
(E)-geranyl acetoneFL/FR
 grapefruit pentanolFR
 green acetateFR
 heliotropyl diethyl acetalFR
(Z)-3-hexen-1-yl benzoateFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
 hexyl 2-methyl butyrateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 hexyl tiglateFL/FR
 hyacinth etherFR
2,4-ivy carbaldehydeFL/FR
 juniper berry oilFL/FR
 lavender absolute bulgariaFL/FR
(Z)-leaf acetalFL/FR
 leerallFR
laevo-linaloolFL/FR
 linalool oxideFL/FR
 lovage root oilFL/FR
 melon heptenalFL/FR
 melon nonenoateFL/FR
 methyl dihydrojasmonateFL/FR
 methyl heptine carbonateFL/FR
 methyl octine carbonateFL/FR
 mimosa absolute franceFL/FR
 muguet carboxaldehydeFR
 muguet octadienolFR
 myrtenyl isobutyrate 
 narcissus absoluteFR
 neryl acetateFL/FR
(E,Z)-2,6-nonadien-1-alFL
(E,Z)-2,6-nonadien-1-olFL/FR
 oakmoss absoluteFL/FR
 ocean propanalFL/FR
 orris pyridine 25% ipmFR
 patchouli ethanoneFR
 pepper oil blackFL/FR
 phenethyl acetateFL/FR
 phenethyl salicylateFL/FR
 phenyl acetaldehydeFL/FR
 phenyl acetaldehyde dimethyl acetalFL/FR
 phenyl acetic acidFL/FR
3-phenyl propionaldehydeFL/FR
3-phenyl propyl alcoholFL/FR
 raspberry ketone methyl etherFL/FR
 santallFR
 spruce oil canadaFL/FR
 strawberry furanoneFL/FR
 styralyl acetateFL/FR
alpha-terpineolFL/FR
 tobacco dodecaneFR
 tonka bean absoluteFR
gamma-undecalactone (aldehyde C-14)FL/FR
1-undecanolFL/FR
 verymossFR
 vetiver oil haitiFL/FR
 violet methyl carbonateFR
 watermelon ketoneFR
 woody acetateFR
 woody amyleneFR
 woody propanolFR
Potential Uses :
 agrumen 
 aldehydicFR
 amaryllis 
 amberFR
 animalFR
 appleFR
 apple crabapple 
 ash mountain ash 
 balsamFR
 bark 
 boxwood 
 boxwood blossom 
 boxwoodberry 
 calamusFR
 celeryFL/FR
 chamomileFR
 champaca champakFR
 cherry wildFL
 chervil 
 chypreFR
 cilantroFL/FR
 citrusFR
 clematisFR
 cloudberry bakeapple 
 cognacFR
 cortex 
 cucumberFR
 cypressFR
 daffodil narcissusFR
 earth humusFR
 eglantine sweet briarFR
 evergreenFR
 fagoniaFR
 fern fougereFR
 figFR
 fir 
 fir needle pine needleFL/FR
 fixer 
 foliage 
 forestFR
 forest pine forestFR
 freshFR
 fruitFR
 galbanumFL/FR
 gardeniaFR
 geraniumFR
 gingerFR
 grass sweetFR
 greenFR
 green grassFR
 green leafFR
 hops houblonFL/FR
 hyacinth jacintheFR
 hydrangeaFR
 ivy leafFR
 jonquil narcissus jonquillaFR
 kewda 
 lavenderFR
 autumnFR
 lemonFR
 limeFR
 lotusFR
 melon watermelon muskmelon cantaloupe 
 mimosaFR
 muguet lily of the valleyFR
 muskFR
 narcissus narcisseFR
 natural 
 nutFL
 oakmoss mousse de chene mossFR
 ocean sea 
 opoponaxFL/FR
 orangeFR
 orange bitterFL/FR
 oreganoFL/FR
 palmarosaFL/FR
 pansyFR
 parsleyFL/FR
 patchouliFR
 pepper 
 pepper greenFL
 pineFR
 pizzaFR
 privet 
 privet blossom 
 radish 
 rain springFR
 reseda mignonetteFR
 resin 
 rhubarbFR
 rose geraniumFR
 sandalwoodFR
 seaweedFL/FR
 spiceFR
 spruceFL/FR
 stem 
 strawberry leaf 
 tea greenFR
 tomatoFL
 tomato leafFR
 vegetable 
 verbenaFR
 vetiverFR
 vine 
 violetFR
 vol de nuit 
 weedy 
 wintergreenFR
 woodyFR
 wormwood absinthiumFL/FR
 yewFR
Natural Occurrence in :    note
 celery leaf S
 celery root S
 galbanum oil S
 mandarin juice  
 parsley  
data pageparsley leaf oil @ 0.20% S


Please share your Information / Comments.

Your email Address:


Top of Page          The Good Scents Company Home
Copyright © 1980-2010 The Good Scents Company Disclaimer Privacy Policy
Html Last modified 08/29/2010