EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

amber furan
grisalva (IFF)

Sponsors

Fragrance Demo Formulas
Name:prop-2-yn-1-ol; 1-(2,6,6-trimethyl-1-cyclohex-2-enyl)pentan-3-one
CAS Number: 68611-23-4Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:271-889-2
Molecular Weight:264.40856000
Formula:C17 H28 O2
NMR Predictor:Predict (works with chrome or firefox)
Category:fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
 
Physical Properties:
Appearance:yellow clear liquid (est)
Assay: 94.00 to 100.00 sum of isomers
Food Chemicals Codex Listed: No
Specific Gravity:0.96100 to 0.96900 @ 25.00 °C.
Pounds per Gallon - (est).: 7.996 to 8.063
Specific Gravity:0.96200 to 0.97000 @ 20.00 °C.
Pounds per Gallon - est.: 8.014 to 8.081
Refractive Index:1.49300 to 1.50000 @ 20.00 °C.
Boiling Point: 273.00 to 274.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.005000 mm/Hg @ 25.00 °C. (est)
Flash Point: 201.00 °F. TCC ( 93.89 °C. )
logP (o/w): 6.580
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, 0.02049 mg/L @ 25 °C (est)
Stability:
 acid cleaner
 alcoholic lotion
 antiperspirant
 bleach
 deo stick
 detergent
 fabric softener
 hard surface cleaner
 shampoo
 soap
 
Organoleptic Properties:
Odor Type: amber
Odor Strength:medium ,
recommend smelling in a 10.00 % solution or less
Substantivity:400 hour(s) at 100.00 %
ambergris animal dry amber fresh metallic
Odor Description:at 10.00 % in dipropylene glycol. ambergris animal dry amber fresh metallic
Luebke, William tgsc, (1992)
Odor sample from: International Flavors & Fragrances Inc.
Odor and/or flavor descriptions from others (if found).
IFF
Grisalva
Odor Description:The character of ambergris captured in a single chemical of remarkable strength. Diffusive and long lasting. Excellent performance/cost ratio
Grisalva is the ethyl analogue of Ambrox, discovered by IFF in the 1960's. Generally, incorporation of an ethyl group in place of a methyl group increases the intensity of the parent chemical. One of the main key characteristics of Grisalva is its exceptional diffusion.
Taytonn
Grisalva
Odor Description:Ambergris, Animalic/ Animal, Leather/ Leathery
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Associate Allied Chemicals
Grisalva
About
Azelis UK
GRISALVA
Services
BOC Sciences
For experimental / research use only.
1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-3-pentanone
Ernesto Ventós
GRISALVA IFF
Odor: ANIMAL,AMBER,LEATHER,EARTHY,TOBACCO
Fine Fragrances Pvt Ltd
Grisalva
IFF
Grisalva
Odor: The character of ambergris captured in a single chemical of remarkable strength. Diffusive and long lasting. Excellent performance/cost ratio
Use: Grisalva is the ethyl analogue of Ambrox, discovered by IFF in the 1960's. Generally, incorporation of an ethyl group in place of a methyl group increases the intensity of the parent chemical. One of the main key characteristics of Grisalva is its exceptional diffusion.
Indukern F&F
GRISALVA
Odor: MUSK, AMBER, AMBERGRIS, ANIMAL
Liaison Carbone
GRISALVA
Penta International
GRISALVA
Perfumery Laboratory
GRIZALVA ™ IFF (GRISALVA ™ IFF)
Odor: Fresh, sweet, with a slightly metallic hue, animalistic amber
Taytonn
Grisalva
Odor: Ambergris, Animalic/ Animal, Leather/ Leathery
The John D. Walsh Company
Grisalva
The Perfumers Apprentice
Grisalva
Odor: Animal, Ambergris, Leather
Use: The character of ambergris captured in a single chemical of remarkable strength. Diffusive and long lasting easier to use than ambroxan
 
Safety Information:
European 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.
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
oral-rat LD50 > 5000 mg/kg

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg

Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: fragrance agents
Recommendation for amber furan usage levels up to:
  0.5000 % in the fragrance concentrate.
 
Recommendation for amber furan flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):68611-23-4
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :163259
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
prop-2-yn-1-ol; 1-(2,6,6-trimethyl-1-cyclohex-2-enyl)pentan-3-one
Chemidplus:0068611234
 
References:
 prop-2-yn-1-ol; 1-(2,6,6-trimethyl-1-cyclohex-2-enyl)pentan-3-one
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:68611-23-4
Pubchem (cid):163259
Pubchem (sid):135119917
 
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:2932.99.8090
ChemSpider:View
EFSA Update of results on the monitoring of furan levels in food:Read Report
EFSA Previous report: Results on the monitoring of furan levels in food:Read Report
EFSA Report of the CONTAM Panel on provisional findings on furan in food:Read Report
 
Potential Blenders and core components note
For Odor
No odor group found for these
satinaldehyde
FL/FR
aldehydic
aldehydic
dodecanal (aldehyde C-12 lauric)
FL/FR
fresh carbaldehyde
FR
2-
methyl undecanal (aldehyde C-12 mna)
FL/FR
2-
methyl undecanal dimethyl acetal
FR
10-
undecenal (aldehyde C-11 undecylenic)
FL/FR
amber
amber acetate
FR
amber butanol
FR
amber carane
FR
amber cyclohexanol
FR
amber decane
FR
amber naphthofuran
FL/FR
amber oxepin
FR
amber spirolene
FR
ambergris naphthol
FR
ambergris tincture
FL/FR
ambrein
FR
ambrette seed oil
FL/FR
ambrinol
FR
alpha-
ambrinol
FL/FR
ambroxan
FL/FR
ambroxide
FL/FR
angelica root oil
FL/FR
cistus ladaniferus absolute resin
FL/FR
cistus ladaniferus resinoid
FR
formoxymethyl isolongifolene
FR
hydroxymethyl isolongifolene 50% in dpg
FR
labdanum absolute
FL/FR
labdanum oil
FL/FR
animal
ambergris tincture replacer
FR
animal carbolactone
FR
iso
butyl quinoline
FR
iso
butyl quinoline
FR
civet absolute
FL/FR
costus valerolactone
FR
para-
cresyl caprylate
FL/FR
para-
cresyl isobutyrate
FL/FR
para-
cresyl phenyl acetate
FL/FR
indolall
FR
indole
FL/FR
indoletal
FR
para-
methyl tetrahydroquinoline
FL/FR
2-
methyl-4-(camphenyl-8) cyclohexanone
FR
skatole
FL/FR
1-oxa
spiro-4,7-dodecane
FR
balsamic
iso
amyl cinnamate
FL/FR
amyl cinnamate
FL/FR
amyl phenyl acetate
FL/FR
amyris wood oil
FL/FR
siam
benzoin resinoid
FL/FR
benzophenone
FR
butyl benzoate
FL/FR
cistus leaf oil
FR
cypress absolute
FR
geranyl benzoate
FL/FR
guaiyl butyrate
FR
linalyl cinnamate
FL/FR
mastic gum resin
FR
myrrh oil
FL/FR
opoponax absolute (commiphora erythraea var. glabrescens engle)
FL/FR
opoponax oil (balsamodendron kafal)
FL/FR
opoponax resinoid (balsamodendron kafal)
FR
iso
propyl cinnamate
FL/FR
propyl cinnamate
FL/FR
sclareol
FL/FR
styrax oil (liquidambar styraciflua)
FL/FR
styrax resinoid (liquidambar styraciflua)
FL/FR
tolu balsam
FL/FR
berry
raspberry ketone
FL/FR
caramellic
ethyl maltol
FL/FR
immortelle absolute
FL/FR
maltol
FL/FR
chocolate
iso
amyl phenyl acetate
FL/FR
iso
butyl phenyl acetate
FL/FR
citrus
aldehydic nitrile
FR
citronellyl nitrile
FR
dodecane nitrile
FR
homo
geranyl nitrile
FR
geranyl nitrile
CS
coconut
gamma-
nonalactone (aldehyde C-18 (so-called))
FL/FR
gamma-
octalactone
FL/FR
dusty
woody furan
FR
earthy
muscogene
FR
ethereal
propyl valerate
FL/FR
propylene glycol dibenzoate
CS
fatty
decanol
FL/FR
delta-
juniper lactone
FL/FR
neryl acetone
FL/FR
floral
amyl benzoate
FL/FR
iso
amyl salicylate
FL/FR
bois de rose oil brazil
FL/FR
boronia butenal
FR
iso
butyl salicylate
FL/FR
para-
cresyl acetate
FL/FR
cyclamen aldehyde
FL/FR
dihydrojasmone
FL/FR
dihydrorose oxide
FR
floral pyran
FR
floral pyranol
FR
heliotropyl acetate
FL/FR
heliotropyl acetone
FL/FR
(Z)-3-
hexen-1-yl salicylate
FL/FR
alpha-
hexyl cinnamaldehyde
FL/FR
hyacinth ether
FR
lilyall
FR
laevo-
linalool
FL/FR
methyl dihydrojasmonate
FL/FR
muguet nitrile
FR
nerolidol
FL/FR
nonanol
FL/FR
ocean propanal
FL/FR
phenethyl butyl ether
FR
phenethyl phenyl acetate
FL/FR
rose carbonate
FR
laevo-
rose oxide
FL/FR
(E)-2,5,9-
trimethyl-4,9-decadien-1-al
FR
tuberolide
FL/FR
fruity
cyclohexyl crotonate
FR
gamma-
decalactone
FL/FR
gamma-
dodecalactone
FL/FR
ethyl 3-hexenoate
FL/FR
linalyl hexanoate
FL/FR
2-
pentyl furan
FL/FR
gamma-
undecalactone (aldehyde C-14 (so-called))
FL/FR
green
chrysanthemum oxide
FL/FR
cognac heptanone
FL/FR
cortex pyridine
FL/FR
diphenyl oxide
FL/FR
galbanum oil
FL/FR
green dioxolane
FR
green ether
FL/FR
1-
hepten-3-ol
FL/FR
heptyl benzoate
FL/FR
(Z)-4-
hexen-1-ol
FL/FR
(Z)-3-
hexen-1-yl butyrate
FL/FR
(Z)-3-
hexen-1-yl octanoate
FL/FR
methyl heptine carbonate
FL/FR
(E,Z)-2,6-
nonadien-1-ol
FL/FR
phenethyl isopropyl ether
FR
iso
propyl quinoline
FR
4-iso
propyl quinoline
FL/FR
violet leaf absolute
FL/FR
hay
beeswax absolute
FL/FR
herbal
(+)-alpha-
campholenic aldehyde
FL/FR
daucus carota fruit oil
FL/FR
ocimene oxirane
FR
petitgrain heptane
FR
safranal
FL/FR
theaspirane
FL/FR
tricyclodecenyl isobutyrate
FR
leathery
castoreum absolute
FL/FR
leather cyclohexanol
FR
marine
marine pyridine
FR
melon
melon heptenal
FL/FR
(Z)-6-
nonenal
FL/FR
watermelon ketone
FR
mossy
veramoss (IFF)
FR
musk
homo
ambrinol
FR
(3alpha,5alpha)-
androst-16-en-3-ol
FR
(Z)-
civet decenone
FL/FR
ethylene dodecanoate
FR
exaltone (Firmenich)
FR
juniper lactone
FL/FR
(E)-3-
methyl-5-cyclotetradecen-1-one
FR
delta-
muscenone
FR
dextro,laevo-
muscone
FL/FR
musk amberol
FR
(E)-12-
musk decenone
FR
musk dimethyl indane
FL/FR
musk lactone
FR
musk methyl ketone
FR
musk nonane
FR
(Z)-
musk pentane
FR
omega-
pentadecalactone
FL/FR
powdery
baby powder fragrance
FR
soapy
ambrettolide
FL/FR
spicy
cassia bark oil china
FL/FR
black
currant bud absolute
FL/FR
iso
eugenyl acetate
FL/FR
sulfurous
cassis pentanone
FL/FR
passiflora acetate
FL/FR
terpenic
angelica seed oil
FL/FR
frankincense oil
FL/FR
tobacco
para-
cresyl isovalerate
FL/FR
tonka
tonka bean absolute
FR
tropical
delta-
dodecalactone
FL/FR
waxy
1-
dodecanol
FL/FR
ethyl laurate
FL/FR
tetradecanal
FL/FR
woody
acetyl cedrene
FR
amber carbinol
FR
amber decatriene
FR
amber dioxane
FR
amber dodecane
FR
amber formate
FR
amber pentadecane
FR
ambrene acetal
FR
amyris acetate
FR
cedar cyclododecatriene
FR
alpha-
cedrene epoxide
FR
cedrol methyl ether
FR
cedryl formate
FR
cedryl methyl ether
FR
cistus twig/leaf absolute
FR
cistus twig/leaf oil
FL/FR
dihydro-beta-ionol
FL/FR
dihydro-beta-ionone
FL/FR
4-(3,3-
dimethyl bicyclo(2.2.1)hept-2-yl)-5-methyl-2-oxabicyclo(2.2.2)octane
FR
frankincense resin
FL/FR
guaiacwood oil
FL/FR
gurjun balsam oil
FR
iso
longifolene ketone
FR
2-
methoxy-4-vinyl phenol
FL/FR
methyl cedryl ketone
FL/FR
patchouli ethanone
FR
patchouli oil
FL/FR
santall
FR
sclareolide
FL/FR
spikenard oil
FL/FR
spruce needle oil canada
FL/FR
timber propanol
FR
tobacarol (IFF)
FR
vetiver oil haiti
FL/FR
woody acetate
FR
woody cyclohexanone
FR
woody dioxolane
FR
woody dodecane
FR
woody epoxide
FR
woody ether
FR
woody ether
FR
woody nonane (ethoxy)
FR
woody nonane (ethoxy)
FR
woody propanol
FR
woody propanol
FR
For Flavor
No flavor group found for these
ambergris tincture
FL/FR
ambroxide
FL/FR
amyl benzoate
FL/FR
amyl phenyl acetate
FL/FR
butyl benzoate
FL/FR
dihydro-beta-ionol
FL/FR
2,6-
dimethoxy-4-vinyl phenol
FL
elecampane root oil
FL
epoxy-2-decenal
FL
geranyl benzoate
FL/FR
heptyl benzoate
FL/FR
linalyl hexanoate
FL/FR
4-
methyl cyclohexanone
FL
para-
methyl tetrahydroquinoline
FL/FR
neryl acetone
FL/FR
4-iso
propyl quinoline
FL/FR
propyl valerate
FL/FR
skatole
FL/FR
spikenard oil
FL/FR
amber
amber
amber naphthofuran
FL/FR
ambrette seed oil
FL/FR
alpha-
ambrinol
FL/FR
angelica seed oil
FL/FR
cistus ladaniferus absolute resin
FL/FR
labdanum absolute
FL/FR
labdanum oil
FL/FR
animal
civet absolute
FL/FR
para-
cresyl caprylate
FL/FR
indole
FL/FR
apple
(E,Z)-2,6-
nonadien-1-ol
FL/FR
aromatic
para-
cresyl acetate
FL/FR
para-
cresyl isobutyrate
FL/FR
balsamic
amyl cinnamate
FL/FR
siam
benzoin resinoid
FL/FR
myrrh oil
FL/FR
opoponax absolute (commiphora erythraea var. glabrescens engle)
FL/FR
opoponax oil (balsamodendron kafal)
FL/FR
iso
propyl cinnamate
FL/FR
styrax oil (liquidambar styraciflua)
FL/FR
styrax resinoid (liquidambar styraciflua)
FL/FR
tolu balsam
FL/FR
berry
heliotropyl acetone
FL/FR
raspberry ketone
FL/FR
brown
beeswax absolute
FL/FR
caramellic
caramel furanone
FL
ethyl maltol
FL/FR
maltol
FL/FR
citrus
cognac heptanone
FL/FR
laevo-
linalool
FL/FR
cocoa
iso
butyl phenyl acetate
FL/FR
coconut
gamma-
nonalactone (aldehyde C-18 (so-called))
FL/FR
cooling
iso
butyl salicylate
FL/FR
theaspirane
FL/FR
creamy
delta-
dodecalactone
FL/FR
gamma-
undecalactone (aldehyde C-14 (so-called))
FL/FR
ethereal
4-
hexen-3-one
FL
fatty
delta-
juniper lactone
FL/FR
tetradecanal
FL/FR
10-
undecenal (aldehyde C-11 undecylenic)
FL/FR
floral
iso
amyl cinnamate
FL/FR
iso
amyl phenyl acetate
FL/FR
bois de rose oil brazil
FL/FR
dihydrojasmone
FL/FR
heliotropyl acetate
FL/FR
methyl dihydrojasmonate
FL/FR
ocean propanal
FL/FR
laevo-
rose oxide
FL/FR
satinaldehyde
FL/FR
fruity
gamma-
decalactone
FL/FR
gamma-
dodecalactone
FL/FR
ethyl 3-hexenoate
FL/FR
linalyl cinnamate
FL/FR
propyl cinnamate
FL/FR
green
iso
amyl salicylate
FL/FR
angelica root oil
FL/FR
(+)-alpha-
campholenic aldehyde
FL/FR
cassis pentanone
FL/FR
chrysanthemum oxide
FL/FR
cortex pyridine
FL/FR
cyclamen aldehyde
FL/FR
diphenyl oxide
FL/FR
galbanum oil
FL/FR
green ether
FL/FR
1-
hepten-3-ol
FL/FR
(Z)-4-
hexen-1-ol
FL/FR
(Z)-3-
hexen-1-yl butyrate
FL/FR
(Z)-3-
hexen-1-yl octanoate
FL/FR
(Z)-3-
hexen-1-yl salicylate
FL/FR
immortelle absolute
FL/FR
melon heptenal
FL/FR
methyl heptine carbonate
FL/FR
nerolidol
FL/FR
(Z)-6-
nonenal
FL/FR
4-
penten-1-yl acetate
FL
2-
pentyl furan
FL/FR
violet leaf absolute
FL/FR
herbal
daucus carota fruit oil
FL/FR
honey
phenethyl phenyl acetate
FL/FR
lactonic
gamma-
octalactone
FL/FR
leathery
castoreum absolute
FL/FR
musk
(Z)-
civet decenone
FL/FR
juniper lactone
FL/FR
dextro,laevo-
muscone
FL/FR
musk dimethyl indane
FL/FR
phenolic
para-
cresyl isovalerate
FL/FR
para-
cresyl phenyl acetate
FL/FR
smoky
2-
methoxy-4-vinyl phenol
FL/FR
soapy
ambrettolide
FL/FR
dodecanal (aldehyde C-12 lauric)
FL/FR
1-
dodecanol
FL/FR
spicy
cassia bark oil china
FL/FR
black
currant bud absolute
FL/FR
iso
eugenyl acetate
FL/FR
tropical
passiflora acetate
FL/FR
vanilla
omega-
pentadecalactone
FL/FR
waxy
decanol
FL/FR
ethyl laurate
FL/FR
furfuryl octanoate
FL
alpha-
hexyl cinnamaldehyde
FL/FR
2-
methyl undecanal (aldehyde C-12 mna)
FL/FR
nonanol
FL/FR
tuberolide
FL/FR
woody
ambroxan
FL/FR
amyris wood oil
FL/FR
cistus twig/leaf oil
FL/FR
dihydro-beta-ionone
FL/FR
frankincense oil
FL/FR
frankincense resin
FL/FR
guaiacwood oil
FL/FR
methyl cedryl ketone
FL/FR
patchouli oil
FL/FR
safranal
FL/FR
sclareol
FL/FR
sclareolide
FL/FR
spruce needle oil canada
FL/FR
vetiver oil haiti
FL/FR
 
Potential Uses:
FRamber
FRambergris
FRanimal
 diffusion
 dry
FRearth
FRherbal
FRleather
FRmusk
FRoriental
FRwoody
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 amber furan
3a-ethyl dodecahydro-6,6,9a-trimethyl naphtho(2,1-b)furan
 ethyl dodecahydrotrimethyl naphthofuran
 grisalva (IFF)
 naphtho(2,1-b)furan,3a-ethyl dodecahydro-6,6,9a-trimethyl
3-pentanone, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, reaction products with 2-propyn-1-ol
 prop-2-yn-1-ol; 1-(2,6,6-trimethyl-1-cyclohex-2-enyl)pentan-3-one
1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-pentanone reaction products with 2-propyn-1-ol
 trimethyl-2-cyclohexenyl-3-pentanone-2-propynol
1-(2,6,6-trimethylcyclohex-2-en-1-yl)pentan-3-one- prop-2-yn-1-ol(1:1)
 

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