gardenia oxide
 
Notes:
Rounds off sharp notes.
Synonyms   Articles   Notes   Search
Name: 3-methylbutoxymethylbenzene
CAS Number: 122-73-6Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 204-570-3
FDA UNII:I8034PF326
Nikkaji Web: J34.766C
Beilstein Number: 2251737
MDL: MFCD00048371
XlogP3-AA: 3.30 (est)
Molecular Weight: 178.27466000
Formula: C12 H18 O
NMR Predictor: Predict (works with chrome or firefox)
Category: fragrance agents
 
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Physical Properties:
Appearance: colorless to pale yellow clear liquid (est)
Assay: 98.00 to 100.00 % sum of isomers
Food Chemicals Codex Listed: No
Specific Gravity: 0.90400 to 0.90800 @  25.00 °C.
Pounds per Gallon - (est).: 7.522 to  7.555
Refractive Index: 1.48100 to 1.48500 @  20.00 °C.
Boiling Point: 237.00 to  238.00 °C. @ 748.00 mm Hg
Boiling Point: 105.00 °C. @ 20.00 mm Hg
Vapor Pressure: 0.101000 mmHg @ 25.00 °C. (est)
Flash Point: > 212.00 °F. TCC ( > 100.00 °C. )
logP (o/w): 3.730 (est)
Shelf Life: 24.00 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
 isopropyl myristate
 paraffin oil
 water, 41.57 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
Odor Type: floral
Odor Strength: medium
Odor Description:
at 100.00 %. 
green bean gardenia jasmin fruity weedy green pea
Substantivity: 12 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 37/38 - Irritating to respiratory system and skin.
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.
Human Experience: 12 % solution: no irritation or sensitization.
Oral/Parenteral Toxicity:
  oral-rat LD50  5000 mg/kg

Dermal Toxicity:
  Not determined
Inhalation Toxicity:
  Not determined
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Safety in Use Information:
Category: fragrance agents
Recommendation for gardenia oxide usage levels up to:
  10.0000 % in the fragrance concentrate.
 
Recommendation for gardenia oxide flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
EPA Substance Registry Services (TSCA): 122-73-6
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 31227
National Institute of Allergy and Infectious Diseases: Data
WGK Germany:2
 3-methylbutoxymethylbenzene
Chemidplus: 0000122736
RTECS: KM9620000 for cas# 122-73-6
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References:
 3-methylbutoxymethylbenzene
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 122-73-6
Pubchem (cid): 31227
Pubchem (sid): 134974050
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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
CHEMBL: View
HMDB (The Human Metabolome Database): Search
Export Tariff Code: 2909.30.6000
ChemSpider: View
Synonyms   Articles   Notes   Search   Top
Potential Blenders and core components note
 
For Odor
aldehydic
 citrus carbaldehydeFR
animal
para-cresyl caprylateFL/FR
para-cresyl isobutyrateFL/FR
para-cresyl phenyl acetateFL/FR
anise
sweet fennel seed oilFL/FR
anisic
 ocimum basilicum herb oilFL/FR
balsamic
isoamyl benzoateFL/FR
 benzyl salicylateFL/FR
 cinnamyl alcoholFL/FR
 ethyl cinnamateFL/FR
3-phenyl propyl alcoholFL/FR
berry
 raspberry ketone methyl etherFL/FR
camphoreous
beta-homocyclocitralFL/FR
citrus
 dihydromyrcenolFL/FR
 grapefruit pentanolFR
 mandarin oil (citrus reticulata var. ponkan)FL/FR
 methyl heptenoneFL/FR
blood orange oil italyFL/FR
 tetrahydromyrcenolFR
ethereal
 ethyl acetateFL/FR
floral
alpha-amyl cinnamaldehydeFL/FR
isoamyl salicylateFL/FR
 benzyl acetateFL/FR
 benzyl alcoholFL/FR
 benzyl isobutyrateFL/FR
 bois de rose oil brazilFL/FR
isobutyl salicylateFL/FR
 citronellolFL/FR
 citronellyl acetateFL/FR
 coriander seed oilFL/FR
para-cresyl acetateFL/FR
2-para-cresyl oxyethyl acetateFR
 cyclamen aldehydeFL/FR
 cyclohexyl ethyl alcoholFL/FR
 dihydrojasmoneFL/FR
 dimethyl anthranilateFL/FR
 dimethyl benzyl carbinolFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 floral pyranolFR
 gelsone (IFF)FL/FR
 geraniolFL/FR
 geranyl acetateFL/FR
 heliotropyl acetoneFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 hyacinth etherFR
 jasmin cyclopentanoneFR
(Z)-jasmoneFL/FR
 leerallFR
 linaloolFL/FR
laevo-linaloolFL/FR
 linalool oxideFL/FR
 methyl dihydrojasmonateFL/FR
 mimosa absolute franceFL/FR
 muguet octadienolFR
 nerolFL/FR
 nerolidolFL/FR
 neryl acetateFL/FR
 nyctanthes arbor-tristis flower oilFR
 ocean propanalFL/FR
 orris pyridine 25% IPMFR
 peony alcoholFR
 petitgrain oil paraguayFL/FR
 phenethyl acetateFL/FR
 phenethyl propionateFL/FR
1-phenyl propyl butyrateFL/FR
 rhodinolFL/FR
 rose butanoateFL/FR
 tetrahydrolinaloolFL/FR
 tuberose absolute (from pommade)FL/FR
 violet methyl carbonateFR
 ylang ylang flower oilFL/FR
fruity
 allyl amyl glycolateFR
 allyl cyclohexyl propionateFL/FR
 benzyl butyrateFL/FR
 benzyl propionateFL/FR
gamma-decalactoneFL/FR
 fruity cyclopentanoneFR
 green acetateFR
2-hexenyl cyclopentanyl acetateFR
 prenyl acetateFL/FR
 strawberry glycidate 1 (aldehyde C-16 (so-called))FL/FR
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
green
 benzyl hexanoateFL/FR
 cortex pyridineFL/FR
para-dimethyl hydroquinoneFL/FR
 diphenyl oxideFL/FR
 galbanum oilFL/FR
(Z)-3-hexen-1-olFL/FR
(Z)-3-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl benzoateFL/FR
(Z)-3-hexen-1-yl formateFL/FR
(Z)-3-hexen-1-yl tiglateFL/FR
(Z)-3-hexenalFL/FR
 hexyl (Z)-tiglateFL/FR
 hexyl 2-methyl butyrateFL/FR
 hexyl tiglateFL/FR
2,4-ivy carbaldehydeFL/FR
(Z)-leaf acetalFL/FR
 melon nonenoateFL/FR
(E,Z)-2,6-nonadien-1-olFL/FR
(Z)-5-octen-1-olFL/FR
 phenyl acetaldehyde dimethyl acetalFL/FR
 styralyl acetateFL/FR
 violet leaf absoluteFL/FR
herbal
 carum carvi fruit oilFL/FR
 clary sage oil franceFL/FR
marine
green algae absoluteFL/FR
melon
 melon heptenalFL/FR
(Z)-6-nonenalFL/FR
naphthyl
para-methyl anisoleFL/FR
powdery
para-anisyl alcoholFL/FR
spicy
alpha-amyl cinnamyl alcoholFL/FR
 pimenta acris leaf oilFL/FR
terpenic
alpha-terpineolFL/FR
waxy
 ethyl laurateFL/FR
woody
 santallFR
(Z)-woody amyleneFR
 
For Flavor
 
No flavor group found for these
green algae absoluteFL/FR
 benzyl hexanoateFL/FR
 hexyl (Z)-tiglateFL/FR
1-phenyl propyl butyrateFL/FR
animal
para-cresyl caprylateFL/FR
anise
sweet fennel seed oilFL/FR
apple
(E,Z)-2,6-nonadien-1-olFL/FR
aromatic
para-cresyl acetateFL/FR
para-cresyl isobutyrateFL/FR
balsamic
 benzyl salicylateFL/FR
 ethyl cinnamateFL/FR
berry
 heliotropyl acetoneFL/FR
 raspberry ketone methyl etherFL/FR
citrus
 linaloolFL/FR
laevo-linaloolFL/FR
 mandarin oil (citrus reticulata var. ponkan)FL/FR
 nerolFL/FR
blood orange oil italyFL/FR
alpha-terpineolFL/FR
cooling
isobutyl salicylateFL/FR
beta-homocyclocitralFL/FR
creamy
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
ethereal
 ethyl acetateFL/FR
fatty
(Z)-3-hexen-1-yl benzoateFL/FR
floral
 bois de rose oil brazilFL/FR
 citronellolFL/FR
 citronellyl acetateFL/FR
 dihydrojasmoneFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 geraniolFL/FR
 methyl dihydrojasmonateFL/FR
 neryl acetateFL/FR
 ocean propanalFL/FR
 phenethyl propionateFL/FR
 rhodinolFL/FR
 tetrahydrolinaloolFL/FR
 tuberose absolute (from pommade)FL/FR
 ylang ylang flower oilFL/FR
fruity
 allyl cyclohexyl propionateFL/FR
isoamyl benzoateFL/FR
para-anisyl alcoholFL/FR
 benzyl acetateFL/FR
 benzyl alcoholFL/FR
 benzyl butyrateFL/FR
 benzyl isobutyrateFL/FR
 benzyl propionateFL/FR
gamma-decalactoneFL/FR
 dimethyl anthranilateFL/FR
 prenyl acetateFL/FR
 rose butanoateFL/FR
 strawberry glycidate 1 (aldehyde C-16 (so-called))FL/FR
 styralyl acetateFL/FR
green
isoamyl salicylateFL/FR
 cinnamyl alcoholFL/FR
 cortex pyridineFL/FR
 cyclamen aldehydeFL/FR
 cyclohexyl ethyl alcoholFL/FR
 dihydromyrcenolFL/FR
para-dimethyl hydroquinoneFL/FR
 diphenyl oxideFL/FR
 galbanum oilFL/FR
 gelsone (IFF)FL/FR
 geranyl acetateFL/FR
(Z)-3-hexen-1-olFL/FR
(Z)-3-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl formateFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
(Z)-3-hexen-1-yl tiglateFL/FR
(Z)-3-hexenalFL/FR
 hexyl 2-methyl butyrateFL/FR
 hexyl tiglateFL/FR
2,4-ivy carbaldehydeFL/FR
(Z)-leaf acetalFL/FR
 linalool oxideFL/FR
 melon heptenalFL/FR
 melon nonenoateFL/FR
 methyl heptenoneFL/FR
 nerolidolFL/FR
(Z)-6-nonenalFL/FR
(Z)-5-octen-1-olFL/FR
 phenyl acetaldehyde dimethyl acetalFL/FR
 violet leaf absoluteFL/FR
herbal
 carum carvi fruit oilFL/FR
 clary sage oil franceFL/FR
 coriander seed oilFL/FR
 ocimum basilicum herb oilFL/FR
 petitgrain oil paraguayFL/FR
honey
 phenethyl acetateFL/FR
medicinal
 dimethyl benzyl carbinolFL/FR
naphthyl
para-methyl anisoleFL/FR
phenolic
para-cresyl phenyl acetateFL/FR
spicy
alpha-amyl cinnamyl alcoholFL/FR
3-phenyl propyl alcoholFL/FR
 pimenta acris leaf oilFL/FR
tropical
alpha-amyl cinnamaldehydeFL/FR
waxy
 ethyl laurateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 mimosa absolute franceFL/FR
woody
(Z)-jasmoneFL/FR
 
Synonyms   Articles   Notes   Search   Top
Potential Uses:
 algaeFR
 angel essenceFR
 crabappleFR
 apple green appleFR
 arrackFL
 artichokeFL
 autumnFR
 avocadoFR
 bananaFR
 barkFR
 basil oil replacerFR
 bergamotFR
 blossom tropical blossom 
 blue mistFR
 bouquetFR
 broccoliFL
 carrot seedFL/FR
 celeryFR
 cherry blossomFR
 christmasFR
 citronellaFR
 cloverFR
 coconut tropical coconutFR
 cucumberFR
 curacaoFR
 daffodilFR
 dill weedFL/FR
 dilleniaFR
 durianFL
 earthFR
 evergreenFR
 fennelFR
 fernFR
 figFR
 fir balsamFR
 fir needle oil replacerFR
 floralFR
 foliageFR
 frangipani plumeriaFR
 freesiaFR
 fruit tropical fruitFL
 galbanumFR
 gardeniaFR
 gooseberryFR
 grapefruitFR
 green leafFR
 hibiscusFR
 hyacinthFR
 iris blossomFR
 ivyFR
 jackfruitFL
 jasminFR
 juniper berryFR
 kiwiFR
 kumquatFR
 lilacFR
 lily water lilyFR
 lotusFR
 magnoliaFR
 mango flowerFR
 marigoldFL/FR
 mimosaFR
 mulberryFR
 narcissusFR
 nectarineFL
 orangeFR
 orchidFR
 osmanthusFR
 pansyFR
 passion blossomFR
 passion fruitFR
 peachFR
 pear prickly pearFL
 pepper tabasco pepperFL
 floralFR
 petuniaFR
 pina coladaFR
 pineFR
 powderFR
 redwoodFR
 rose wild rose 
 scented stockFR
 sherryFR
 spearmintFR
 teaFL
 tomatoFL
 tropicalFL
 tulipFR
 vegetableFL
 vetiverFR
 vine 
 wallflowerFR
 wasabiFL
 weedy 
 wormwood oil replacerFR
 ylang ylangFR
Synonyms   Articles   Notes   Search   Top
Occurrence (nature, food, other): note
 not found in nature
Synonyms   Articles   Notes   Search   Top
Synonyms:
isoamyl benzyl ether
tert-amyl benzyl ether
 benzene, ((3-methylbutoxy)methyl)-
 benzene, [(3-methylbutoxy)methyl]-
 benzyl 3-methylbutyl ether
 benzyl isoamyl ether
 benzyl isopentyl ether
 ether, benzyl isopentyl
 gardenia ether (Bedoukian)
 gardenia oxide
((3-methyl butoxy)methyl) benzene
[(3-methylbutoxy)methyl]benzene
3-methylbutoxymethylbenzene
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