galbanum decatriene
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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
jecfa number :1341
fl. number :01.061
molar refractivity :52.85 ± 0.3 cm3
parachor :433.2 ± 4.0 cm3
index of refraction :1.461 ± 0.02
surface tension :25.6 ± 3.0 dyne/cm
density :0.780 ± 0.06 g/cm3
polarizability :20.95 ± 0.5 10-24cm3
XlogP : 4.10
molecular weight : 150.2606200 (IUPAC)
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
parachor :433.2 ± 4.0 cm3
index of refraction :1.461 ± 0.02
surface tension :25.6 ± 3.0 dyne/cm
density :0.780 ± 0.06 g/cm3
polarizability :20.95 ± 0.5 10-24cm3
XlogP : 4.10
molecular weight : 150.2606200 (IUPAC)
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
parachor :433.2 ± 4.0 cm3
index of refraction :1.461 ± 0.02
surface tension :25.6 ± 3.0 dyne/cm
density :0.780 ± 0.06 g/cm3
polarizability :20.95 ± 0.5 10-24cm3
XlogP : 4.10
molecular weight : 150.2606200 (IUPAC)
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
parachor :433.2 ± 4.0 cm3
index of refraction :1.461 ± 0.02
surface tension :25.6 ± 3.0 dyne/cm
density :0.780 ± 0.06 g/cm3
polarizability :20.95 ± 0.5 10-24cm3
XlogP : 4.10
molecular weight : 150.2606200 (IUPAC)
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
parachor :433.2 ± 4.0 cm3
index of refraction :1.461 ± 0.02
surface tension :25.6 ± 3.0 dyne/cm
density :0.780 ± 0.06 g/cm3
polarizability :20.95 ± 0.5 10-24cm3
XlogP : 4.10
molecular weight : 150.2606200 (IUPAC)
formula :C11 H18
NMR Predictor :Predict
 
 
export tariff code :2901.29.6000
fda reg :unspecified
Suppliers :
Bedoukian Research :1,3,5-UNDECATRIENE
≥96.0% (sum of isomers), FCC, Kosher
Odor:  fresh green, resinous, galbanum, green pepper
Bedoukian Research :UNDECATRIENE
≥97.0%, Kosher
Odor:  galbanum-like
Berje :Undecatriene
Firmenich :GALBANOLENE SUPER
Odor:  fresh green greasy resin galbanum green pepper
Givaudan :Undecatriene
10%/TEC
Odor:  Intense, Galbanum, Green, Herbaceous
Penta :1,3,5-undecatriene
Sigma-Aldrich-SAFC :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 description¹ :
at 1.00 % in dipropylene glycol.  		fresh green greasy resin galbanum green pepper
odor sample from :Firmenich & Company Inc.
odor description³ :
Fresh green, cucumber, waxy, melon and vegetative, citrus
taste description³ :
Green, vegetative, waxy, cucumber, chicken, fatty and fried notes
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 - calc. : 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 :
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
RTECS :YQ2833000 for cas# 16356-11-9
chemidplus :016356119
EPA Substance Registry Services :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
fl. number :01.061
jecfa number :1341
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 :
reference : Luebke, William tgsc, (1994)¹
reference : Mosciano, Gerard P&F 18, No. 5, 39, (1993)³
CosIng :cosmetic data
VCF-Online: VCF Volatile Compounds in Food
RIFM :listed
FMA :listed
FDA Everything Added to Food in the United States (EAFUS)View
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 :
 abies alba mill oilFL/FR
 acetaldehyde ethyl phenethyl acetalFL/FR
 algae absoluteFR
 allyl amyl glycolateFR
 ambroxanFL/FR
isoamyl benzoateFL/FR
 amyris wood oilFR
 animal carbolactoneFR
 anise seed oilFL/FR
para-anisyl alcoholFL/FR
 basil oilFL/FR
 bay leaf oilFL/FR
 benzoin resinoidFL/FR
 benzyl alcoholFL/FR
 benzyl benzoateFL/FR
 benzyl salicylateFL/FR
 bois de rose oilFL/FR
 camphor oilFL/FR
 caraway seed oilFL/FR
 carrot seed oilFL/FR
 cedarleaf oilFL/FR
 cedarwood oils 
 cinnamyl alcoholFL/FR
 cistus oilFL/FR
 citronellyl acetateFL/FR
 citrus carbaldehydeFR
 clary sage oilFL/FR
 clover nitrileFR
 cognac oilFL/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
 decanalFL/FR
 decyl acetateFL/FR
 dihydromyrcenolFL/FR
 dimethyl hydroquinoneFL/FR
 dodecanalFL/FR
 dodecanolFL/FR
 ethyl laurateFL/FR
 fir balsam absoluteFL/FR
 fir needle oilFL/FR
 floral pyranolFR
 flouve absoluteFR
 frankincense oilFL/FR
 geranyl acetateFL/FR
(E)-geranyl acetoneFL/FR
 grapefruit pentanolFR
 green acetateFR
 heliotropyl diethyl acetalFL/FR
(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
 ionones 
2,4-ivy carbaldehydeFL/FR
 juniper berry oilFL/FR
 lavender absoluteFL/FR
 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 ionones 
 methyl octine carbonateFL/FR
 mimosa absoluteFL/FR
 muguet carboxaldehydeFR
 muguet octadienolFR
 musks 
 myrtenyl isobutyrateFL/FR
 narcissus absoluteFR
 neryl acetateFL/FR
(E,Z)-2,6-nonadien-1-alFL/FR
(E,Z)-2,6-nonadien-1-olFL/FR
 oakmoss absoluteFL/FR
 ocean propanalFL/FR
 orris pyridineFL/FR
 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
 rose oxides 
 santallFR
 spruce oilFL/FR
 strawberry furanoneFL/FR
 styralyl acetateFL/FR
alpha-terpineolFL/FR
 tobacco dodecaneFR
 tonka bean absoluteFR
gamma-undecalactoneFL/FR
 undecanolFL/FR
 verymossFR
 vetiver oilFL/FR
 violet methyl carbonateFR
 watermelon ketoneFR
 woody acetateFR
 woody amyleneFR
 woody propanolFR
potential uses :
 agrumen
 aldehydic
 amaryllis
 amber
 animal
 apple
 apple crabapple
 ash mountain ash
 balsam
 bark
 boxwood
 boxwood blossom
 boxwoodberry
 briar sweet briar eglantine
 calamus
 celery
 chamomile
 champaca champak
 cherry wild cherry
 chervil
 chypre
 cilantro
 citrus
 clematis
 cloudberry bakeapple
 cognac
 cortex
 cucumber
 cypress
 daffodil narcissus
 earth humus
 evergreen
 fagonia
 fern fougere
 fig
 fir
 fixer
 foliage
 forest
 forest pine forest
 fresh
 fruit
 galbanum
 gardenia
 geranium
 ginger
 grass green grass
 grass sweet grass
 green
 hops houblon
 hyacinth jacinthe
 hydrangea
 ivy leaf
 jonquil narcissus jonquilla
 kewda
 lavender
 leaf autumn leaf
 leaf green leaf
 lemon
 lime
 lotus
 melon watermelon muskmelon cantaloupe
 mimosa wattle
 moss
 muguet lily of the valley
 musk
 narcissus narcisse
 natural
 nut
 ocean sea
 opoponax
 orange
 orange bitter orange
 oregano
 palmarosa
 pansy
 parsley
 patchouli
 pepper
 pepper bell pepper
 pine
 pine needle
 pizza
 privet
 privet blossom
 radish
 rain spring rain
 reseda mignonette
 resin
 rhubarb
 rose geranium
 sandalwood
 seaweed
 spice
 spruce
 stem
 strawberry leaf
 tea green tea
 tomato
 tomato leaf
 vegetable
 verbena verveine
 vetiver
 vine
 violet
 vol de nuit
 weedy
 wintergreen
 woody
 wormwood absinthium
 yew
natural occurrence in :
 celery leaf S
 celery root S
 galbanum oil S
 mandarin juice  
 parsley  
data pageparsley leaf oil @ 0.20% S



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