woody carboxylate
 
Notes:
Has vary good blending power.
Synonyms   Articles   Notes   Search
4-methyl-1-propan-2-ylbicyclo[2.2.2]oct-2-ene-8-carboxylate (Click)
CAS Number: 68966-86-9Picture of molecule
Other: 68928-82-5
ECHA EINECS - REACH Pre-Reg: 273-453-7
Nikkaji Web: J310.242D
XlogP3-AA: 3.90 (est)
Molecular Weight: 222.32774000
Formula: C14 H22 O2
NMR Predictor: Predict (works with chrome or firefox)
Also(can) Contains: methyl 4-isopropyl-1-methyl bicyclo(2.2.2)oct-5-ene-2-carboxylate
Category: fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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Physical Properties:
Appearance: colorless clear oily liquid (est)
Assay: 98.00 to 100.00 % sum of isomers
Food Chemicals Codex Listed: No
Specific Gravity: 1.00000 to 1.00500 @  25.00 °C.
Pounds per Gallon - (est).: 8.321 to  8.363
Refractive Index: 1.47700 to 1.49500 @  20.00 °C.
Boiling Point: 261.00 to  262.00 °C. @ 760.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure: 0.011000 mm/Hg @ 25.00 °C. (est)
Flash Point: > 200.00 °F. TCC ( > 93.33 °C. )
logP (o/w): 4.885 (est)
Shelf Life: 36.00 month(s) or longer if stored properly.
Storage: store in cool, dry place in tightly sealed containers, protected from heat and light.
Soluble in:
 alcohol
 water, 3.762 mg/L @ 25 °C (est)
Stability:
 AP roll-on 15% (very good)
 bleach (poor)
 body lotion (poor)
 cleaner APC liquid (good)
 cleaner liquid citric acid (good)
 detergent powder conc. (good)
 shampoo/shower gel (good)
 soap (good)
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Organoleptic Properties:
Odor Type: woody
Odor Strength: medium
Odor Description:
at 100.00 %. 
woody dry clean mahogany dank sawdust
Substantivity: 73 hour(s) at 100.00 %
  
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
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Safety Information:
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/Parenteral Toxicity:
  Not determined
Dermal Toxicity:
  Not determined
Inhalation Toxicity:
  Not determined
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Safety in Use Information:
Category: fragrance agents
Recommendation for woody carboxylate usage levels up to:
  8.0000 % in the fragrance concentrate.
 
Recommendation for woody carboxylate flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
EPA Substance Registry Services (TSCA): 68966-86-9
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 106713
National Institute of Allergy and Infectious Diseases: Data
WISER: UN 3082
WGK Germany:2
 4-methyl-1-propan-2-ylbicyclo[2.2.2]oct-2-ene-8-carboxylate
Chemidplus: 0068966869
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References:
 4-methyl-1-propan-2-ylbicyclo[2.2.2]oct-2-ene-8-carboxylate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 68966-86-9
Pubchem (cid): 106713
Pubchem (sid): 135064313
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Other Information:
(IUPAC): Atomic Weights of the Elements 2009
(IUPAC): Atomic Weights of the Elements 2009 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
HMDB (The Human Metabolome Database): Search
Export Tariff Code: 3302.90.9090
ChemSpider: View
Synonyms   Articles   Notes   Search   Top
Potential Blenders and core components note
 
For Odor
aldehydic
 citrus carbaldehydeFR
 dodecanal (aldehyde C-12 lauric)FL/FR
2-methyl undecanal (aldehyde C-12 mna)FL/FR
 nonanal (aldehyde C-9)FL/FR
10-undecenal (aldehyde C-11 undecylenic)FL/FR
amber
 amber naphthofuranFL/FR
 amber oxepinFR
 amber spiroleneFR
 ambrette seed absoluteFL/FR
 ambroxanFL/FR
 angelica root oilFL/FR
 cistus ladaniferus resinoidFR
 labdanum oilFL/FR
animal
 animal carbolactoneFR
isobutyl quinolineFR
isobutyl quinolineFR
 costus valerolactoneFR
para-cresyl caprylateFL/FR
 indoleFL/FR
anisic
 ambrette seed oilFL/FR
para-anisaldehydeFL/FR
balsamic
isoamyl benzoateFL/FR
 amyris wood oilFL/FR
siam benzoin resinoidFL/FR
 benzophenoneFL/FR
1-benzoyl acetoneFL/FR
 benzyl cinnamateFL/FR
 benzyl salicylateFL/FR
isobutyl cinnamateFL/FR
 cinnamyl alcoholFL/FR
 cistus leaf oilFR
 clover nitrileFR
 ethyl cinnamateFL/FR
 fir balsam absoluteFR
 fir needle oil siberiaFL/FR
 methyl cinnamateFL/FR
3-phenyl propyl alcoholFL/FR
berry
 raspberry ketone methyl etherFL/FR
camphoreous
 fencholFL/FR
chocolate
isoamyl phenyl acetateFL/FR
citrus
 bergamot oilFL/FR
 grapefruit oil c.p. californiaFL/FR
 grapefruit pentanolFR
blood orange oil italyFL/FR
bitter orange peel oil brazilFL/FR
sweet orange peel oil c.p. brazilFL/FR
bitter orange peel oil italyFL/FR
coconut
gamma-nonalactone (aldehyde C-18 (so-called))FL/FR
gamma-octalactoneFL/FR
fatty
 decanolFL/FR
floral
isoamyl salicylateFL/FR
 benzyl acetateFL/FR
 bois de rose oil brazilFL/FR
isobutyl salicylateFL/FR
 citronellolFL/FR
 citronellyl acetateFL/FR
 coriander seed oilFL/FR
 cyclamen aldehydeFL/FR
 cyclohexyl ethyl alcoholFL/FR
9-decen-1-olFL/FR
 dihydrojasmoneFL/FR
 dimethyl benzyl carbinolFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 floral pyranolFR
 floral undecenoneFR
 gardenia decaloneFR
 gardenia oxideFR
 geraniolFL/FR
 heliotropinFL/FR
 heliotropyl acetoneFL/FR
 heliotropyl diethyl acetalFR
(Z)-3-hexen-1-yl salicylateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 hyacinth etherFR
 hydroxycitronellalFL/FR
 leerallFR
 linaloolFL/FR
laevo-linaloolFL/FR
 linalool oxideFL/FR
para-methyl acetophenoneFL/FR
 methyl dihydrojasmonateFL/FR
 mimosa absolute franceFL/FR
 muguet carboxaldehydeFR
 muguet octadienolFR
 nerolFL/FR
 nerolidolFL/FR
 nonanolFL/FR
 ocean propanalFL/FR
 orris pyridine 25% IPMFR
 peony alcoholFR
 petitgrain oil paraguayFL/FR
 phenethyl acetateFL/FR
 phenethyl alcoholFL/FR
 phenethyl phenyl acetateFL/FR
 phenethyl salicylateFL/FR
 rhodinolFL/FR
 rose butanoateFL/FR
 tetrahydrolinaloolFL/FR
fruity
 allyl amyl glycolateFR
 allyl cyclohexyl propionateFL/FR
 artemisia pallens herb oilFL/FR
 benzyl propionateFL/FR
 dimethyl benzyl carbinyl isobutyrateFR
 green acetateFR
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
green
para-dimethyl hydroquinoneFL/FR
 galbanum oilFL/FR
(Z)-3-hexen-1-yl benzoateFL/FR
(Z)-3-hexen-1-yl propionateFL/FR
(Z)-3-hexen-1-yl tiglateFL/FR
 hexyl 2-methyl butyrateFL/FR
 hexyl tiglateFL/FR
 methyl cyclocitrone (IFF)FR
 oakmoss oilFR
 phenyl acetaldehyde dimethyl acetalFL/FR
 seaweed absolute (fucus vesiculosus et serratus)FL/FR
hay
 beeswax absoluteFL/FR
 hay absoluteFR
herbal
 carum carvi fruit oilFL/FR
 clary sage oil franceFL/FR
 daucus carota fruit oilFL/FR
 herbal careneFR
 lavandin water absoluteFL/FR
 linalyl acetateFL/FR
 nopyl acetateFR
beta-pineneFL/FR
laevo-beta-pineneFL/FR
leathery
 castoreum absoluteFL/FR
marine
 marine pyridineFR
melon
 watermelon ketoneFR
mossy
 oakmoss absoluteFL/FR
 treemoss absoluteFR
 veramoss (IFF)FR
musk
 dehydro beta-linaloolFL/FR
 musk dodecaneFR
naphthyl
para-methyl anisoleFL/FR
powdery
para-anisyl alcoholFL/FR
spicy
 allspice oilFL/FR
 benzyl isoeugenolFL/FR
 caryophyllene alcoholFL/FR
 cassia bark oil chinaFL/FR
 clove bud oilFL/FR
 cuminaldehydeFL/FR
 eugenolFL/FR
isoeugenyl acetateFL/FR
 methyl isoeugenolFL/FR
black pepper oilFL/FR
 pimenta acris leaf oilFL/FR
terpenic
 frankincense oilFL/FR
alpha-terpineolFL/FR
thujonic
 armoise oilFR
 sage oil dalmatianFL/FR
tonka
 coumarinFR
 tonka bean absoluteFR
vanilla
 ethyl vanillinFL/FR
 vanilla bean absolute (vanilla planifolia)FL/FR
 vanillyl acetateFL/FR
waxy
 decyl acetateFL/FR
1-dodecanolFL/FR
 ethyl laurateFL/FR
1-undecanolFL/FR
woody
 amber carbinolFR
 amber formateFR
 amber pentadecaneFR
 bornyl valerateFL/FR
 cabreuva wood oilFR
beta-caryophyllene alcohol acetateFL/FR
beta-caryophyllene oxideFL/FR
atlas cedarwood absoluteFR
atlas cedarwood oilFR
epoxidized cedarwood oilFR
 cedarwood oil virginiaFR
 cedrela wood oilFR
 cedrenyl acetateFR
 cedrol methyl etherFR
 cedryl acetateFL/FR
 cistus ladaniferus gumFR
 cistus twig/leaf oilFL/FR
2-decalinyl formateFR
 guaiacwood oilFL/FR
 guaiacyl acetateFL/FR
 guaieneFL/FR
 gurjun balsam oilFR
 hinoki root oilFR
 labdanum concreteFR
 labdanum ethanoneFR
isolongifolene epoxideFR
isolongifolene ketoneFR
para-menth-3-en-1-olFL/FR
2-methoxy-4-vinyl phenolFL/FR
 methyl cedryl ketoneFL/FR
 methyl vetivateFR
 patchouli oilFL/FR
 sandalwood oil west australia (santalum spicata)FR
 santallFR
 spruce needle oil canadaFL/FR
 timber propanolFR
 tobacarol (IFF)FR
 tobacco noneneFR
 woody acetateFR
(Z)-woody amyleneFR
 woody epoxideFR
 woody epoxideFR
 woody etherFR
 woody etherFR
 woody propanolFR
 woody propanolFR
 
For Flavor
 
No flavor group found for these
 ambrette seed oilFL/FR
1-benzoyl acetoneFL/FR
 caryophyllene alcoholFL/FR
beta-caryophyllene alcohol acetateFL/FR
 cistus twig/leaf oilFL/FR
 dehydro beta-linaloolFL/FR
para-menth-3-en-1-olFL/FR
laevo-beta-pineneFL/FR
 seaweed absolute (fucus vesiculosus et serratus)FL/FR
aldehydic
 nonanal (aldehyde C-9)FL/FR
1-undecanolFL/FR
amber
 amber naphthofuranFL/FR
 labdanum oilFL/FR
animal
para-cresyl caprylateFL/FR
 indoleFL/FR
balsamic
siam benzoin resinoidFL/FR
 benzyl salicylateFL/FR
isobutyl cinnamateFL/FR
 ethyl cinnamateFL/FR
 fir needle oil siberiaFL/FR
berry
 heliotropyl acetoneFL/FR
 raspberry ketone methyl etherFL/FR
brown
 beeswax absoluteFL/FR
camphoreous
 fencholFL/FR
cherry
 heliotropinFL/FR
citrus
 bergamot oilFL/FR
 grapefruit oil c.p. californiaFL/FR
laevo-linaloolFL/FR
 linaloolFL/FR
 nerolFL/FR
blood orange oil italyFL/FR
sweet orange peel oil c.p. brazilFL/FR
bitter orange peel oil italyFL/FR
 petitgrain oil paraguayFL/FR
alpha-terpineolFL/FR
coconut
gamma-nonalactone (aldehyde C-18 (so-called))FL/FR
cooling
isobutyl salicylateFL/FR
creamy
para-anisaldehydeFL/FR
para-methyl acetophenoneFL/FR
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
fatty
(Z)-3-hexen-1-yl benzoateFL/FR
10-undecenal (aldehyde C-11 undecylenic)FL/FR
floral
isoamyl phenyl acetateFL/FR
 bois de rose oil brazilFL/FR
 citronellolFL/FR
 citronellyl acetateFL/FR
 dihydrojasmoneFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 geraniolFL/FR
 linalyl acetateFL/FR
 methyl dihydrojasmonateFL/FR
 ocean propanalFL/FR
 phenethyl alcoholFL/FR
 rhodinolFL/FR
 tetrahydrolinaloolFL/FR
fruity
 allyl cyclohexyl propionateFL/FR
isoamyl benzoateFL/FR
para-anisyl alcoholFL/FR
 artemisia pallens herb oilFL/FR
 benzyl acetateFL/FR
 benzyl propionateFL/FR
bitter orange peel oil brazilFL/FR
 rose butanoateFL/FR
geranium
 benzophenoneFL/FR
green
isoamyl salicylateFL/FR
 angelica root oilFL/FR
 cinnamyl alcoholFL/FR
 cyclamen aldehydeFL/FR
 cyclohexyl ethyl alcoholFL/FR
para-dimethyl hydroquinoneFL/FR
 galbanum oilFL/FR
(Z)-3-hexen-1-yl propionateFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
(Z)-3-hexen-1-yl tiglateFL/FR
 hexyl 2-methyl butyrateFL/FR
 hexyl tiglateFL/FR
 linalool oxideFL/FR
 nerolidolFL/FR
 oakmoss absoluteFL/FR
 phenyl acetaldehyde dimethyl acetalFL/FR
herbal
 carum carvi fruit oilFL/FR
 clary sage oil franceFL/FR
 coriander seed oilFL/FR
 daucus carota fruit oilFL/FR
 lavandin water absoluteFL/FR
honey
 phenethyl acetateFL/FR
 phenethyl phenyl acetateFL/FR
lactonic
gamma-octalactoneFL/FR
leathery
 castoreum absoluteFL/FR
medicinal
 dimethyl benzyl carbinolFL/FR
 phenethyl salicylateFL/FR
naphthyl
para-methyl anisoleFL/FR
pine
beta-pineneFL/FR
smoky
2-methoxy-4-vinyl phenolFL/FR
soapy
 dodecanal (aldehyde C-12 lauric)FL/FR
1-dodecanolFL/FR
spicy
 allspice oilFL/FR
 benzyl cinnamateFL/FR
 benzyl isoeugenolFL/FR
 cassia bark oil chinaFL/FR
 clove bud oilFL/FR
 cuminaldehydeFL/FR
 eugenolFL/FR
isoeugenyl acetateFL/FR
 methyl cinnamateFL/FR
 methyl isoeugenolFL/FR
black pepper oilFL/FR
3-phenyl propyl alcoholFL/FR
 pimenta acris leaf oilFL/FR
thujonic
 sage oil dalmatianFL/FR
vanilla
 ethyl vanillinFL/FR
 vanilla bean absolute (vanilla planifolia)FL/FR
 vanillyl acetateFL/FR
waxy
 decanolFL/FR
9-decen-1-olFL/FR
 decyl acetateFL/FR
 ethyl laurateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 hydroxycitronellalFL/FR
2-methyl undecanal (aldehyde C-12 mna)FL/FR
 mimosa absolute franceFL/FR
 nonanolFL/FR
woody
 ambrette seed absoluteFL/FR
 ambroxanFL/FR
 amyris wood oilFL/FR
 bornyl valerateFL/FR
beta-caryophyllene oxideFL/FR
 cedryl acetateFL/FR
 frankincense oilFL/FR
 guaiacwood oilFL/FR
 guaiacyl acetateFL/FR
 guaieneFL/FR
 methyl cedryl ketoneFL/FR
 patchouli oilFL/FR
 spruce needle oil canadaFL/FR
 
Synonyms   Articles   Notes   Search   Top
Potential Uses:
 amberFR
 ambergrisFR
 ambreine 
 angelicaFL/FR
 cabreuvaFR
 christmas blendsFR
 cistusFL/FR
 clean 
 dogwoodFR
 floralFR
 herbalFR
 hinokiFR
 labdanumFL/FR
 orange bitterFL/FR
 orientalFR
 patchouliFR
 sandalwoodFR
 spiceFR
 woodyFR
Synonyms   Articles   Notes   Search   Top
Occurrence (nature, food, other): note
 not found in nature
Synonyms   Articles   Notes   Search   Top
Synonyms:
 arboroma
 bicyclo(2.2.2)oct-5-ene-2-carboxylic acid, 1(or 4)-methyl-4(or 1)-(1-methylethyl)-, methyl ester
5(6)-carbomethoxy-1-methyl-4-isopropyl bicyclo(2.2.2)oct-2-ene
5(6)-carbomethoxy-1-methyl-4-isopropyl-bicyclo[2.2.2.]oct-2-ene
 mahagonat (Symrise)
 mahagonate (Symrise)
 methyl 1-methyl-4-isopropyl bicyclo(2.2.2)oct-5-ene carboxylate
 methyl 1-methyl-4-propan-2-yl bicyclo(2.2.2)oct-2-ene-7-carboxylate
 methyl 4(or 1)-isopropyl-1(or 4)-methyl bicyclo(2.2.2)oct-5-ene-2-carboxylate
 methyl 4(or 1)-isopropyl-1(or 4)-methylbicyclo(2.2.2)oct-5-ene-2-carboxylate
 methyl isopropyl methyl bicyclooctene-2-carboxylate
4-methyl-1-propan-2-ylbicyclo[2.2.2]oct-2-ene-8-carboxylate
 poivrol (Symrise)
 woody carboxylate
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