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

dihexyl (E)-fumarate
fumaric acid, dihexyl ester

Sponsors

Name:dihexyl (E)-but-2-enedioate
CAS Number: 19139-31-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:242-833-4
FDA UNII:6B3O343SS2
Nikkaji Web:J34.714K
XlogP3-AA:4.90 (est)
Molecular Weight:284.39596000
Formula:C16 H28 O4
NMR Predictor:Predict (works with chrome or firefox)
Also(can) Contains:dihexyl (Z)-fumarate
Category:fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
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Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 98.00 to 100.00 sum of isomers
Food Chemicals Codex Listed: No
Boiling Point: 354.00 to 355.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.000020 mm/Hg @ 25.00 °C. (est)
Flash Point: 333.00 °F. TCC ( 167.22 °C. )
logP (o/w): 5.525 (est)
Soluble in:
 alcohol
 water, 0.08899 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: herbal
Odor Strength:medium
Substantivity:128 hour(s) at 100.00 %
fresh floral green magnolia plastic herbal cortex
Odor Description:at 100.00 %. fresh floral green magnolia plastic herbal cortex
Luebke, William tgsc, (1989)
Odor sample from: Fritzsche Dodge & Olcott, Inc.
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Frinton Laboratories
For experimental / research use only.
Dihexyl Fumarate
Penta International
DIHEXYL FUMARATE
 
Safety Information:
 
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:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: fragrance agents
Recommendation for dihexyl (E)-fumarate usage levels up to:
  4.0000 % in the fragrance concentrate.
 
Recommendation for dihexyl (E)-fumarate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):19139-31-2
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5271574
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
dihexyl (E)-but-2-enedioate
Chemidplus:0019139312
 
References:
 dihexyl (E)-but-2-enedioate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:19139-31-2
Pubchem (cid):5271574
Pubchem (sid):134993672
 
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:2917.19.7055
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aldehydic
iso
butyraldehyde
FL/FR
6,7,8-
decen-1-ol
FR
dodecanal (aldehyde C-12 lauric)
FL/FR
3-
methyl-4-hexyl oxybutyraldehyde
FR
muguet undecadienal
FR
balsamic
cinnamyl formate
FL/FR
citrus
bergamot oil
FL/FR
bergamot oil bergaptene reduced italy
FL/FR
bergamot oil turkey
FL/FR
citral dimethyl acetal
FL/FR
citrus floral green fragrance
FR
(E)-4-
decenal
FL/FR
iso
decyl acetate
FR
2,4-
dimethyl-3-cyclohexene-1-methanyl acetate
FR
grapefruit pentanol
FR
nonanal dimethyl acetal
FL/FR
(E)-2-
tetradecenal
FL/FR
2-
tetradecenal
FL/FR
ethereal
ethyl 4-pentenoate
FL/FR
fatty
2-
decenal
FL/FR
(E)-2-
octenal
FL/FR
floral
acetaldehyde dibutyl acetal
FL/FR
amyl benzoate
FL/FR
amyl cyclopentanone propanone
FR
amyl salicylate
FL/FR
anisyl propanal / methyl anthranilate schiff's base
FR
boronia concrete
FL/FR
alpha-
butyl cinnamaldehyde
FL/FR
citronellyl acetate
FL/FR
citronellyl propionate
FL/FR
coriander seed oil CO2 extract
FL/FR
cumin carbinol
FR
cuminyl acetaldehyde
FL/FR
dictamnus hispanicus oil
FR
dihydrocarvyl acetate
FL/FR
(±)-2,3-
dihydrofarnesol
FL/FR
dihydroisojasmonate methyl ester
FR
dihydrorose oxide
FR
dimethyl benzyl carbinol
FL/FR
dimethyl benzyl carbinyl butyrate
FL/FR
6,8-
dimethyl-2-nonanol
FR
ethyl 2-benzyl butyrate
FL/FR
ethyl phenoxyacetate
FR
farnesol
FL/FR
farnesyl acetate
FL/FR
floral butanal
FR
floral undecenone
FR
gardenia absolute
FR
gardenia acetal
FR
gardenia concrete
FR
geranium oil
FL/FR
geranium oil africa
FL/FR
geranium oil bourbon
FL/FR
geranium oil egypt
FL/FR
geranyl acetone
FL/FR
(E)-
geranyl acetone
FL/FR
geranyl formate
FL/FR
geranyl isobutyrate
FL/FR
(Z)-4-
hepten-2-yl salicylate
FR
(Z)-3-
hexen-1-yl salicylate
FL/FR
alpha-
hexyl cinnamaldehyde
FL/FR
hexyl lactate
FL/FR
hyacinth oil
FR
hydrangea fragrance
FR
hydroxycitronellal diethyl acetal
FL/FR
hydroxycitronellal propylene glycol acetal
FL/FR
jasmin cyclopentanol
FR
jonquil absolute
FR
lilac absolute
FR
lily fragrance
FR
lily propanol
FR
linalyl phenyl acetate
FL/FR
lotus fragrance
FR
magnolia cyclohexanol
FR
magnolia decadienal
FR
magnolia indene
FR
(2-
methoxy-1-methyl propyl) benzene
FR
(3-
methoxy-2-methyl propyl) benzene
FR
1-(2-
methyl allyl oxy)-2-methyl butane
FR
mimosa absolute
FL/FR
mimosa absolute france
FL/FR
mimosa absolute india
FL/FR
muguet shiseol
FL/FR
nerol
FL/FR
neroli oil bigarde
FL/FR
neroli oil CO2 extract
FL/FR
nerolidol
FL/FR
(E)-
nerolidol
FL/FR
ocean propanal
FL/FR
ocean propanal / methyl anthranilate schiff's base
FR
orange leaf absolute
FL/FR
bitter
orangeflower absolute tunisia
FL/FR
orchid specialty
FR
papaya isobutyrate
FL/FR
2-
pentyl cyclopentanone
FR
phenyl acetaldehyde dicitronellyl acetal
FR
phenyl acetaldehyde diisobutyl acetal
FL/FR
2-
phenyl propionaldehyde ethylene glycol acetal
FR
propyl anthranilate
FL/FR
rhodinyl formate
FL/FR
rose butanoate
FL/FR
(Z)-
rose oxide
FL/FR
laevo-
rose oxide
FL/FR
rose petal acetate
FR
rose pyran
FR
styralyl formate
FL/FR
sweet pea absolute
FR
terpinyl isobutyrate
FL/FR
5-
tricyclodecenyl acetate
FR
(S,E)-3,7,11-
trimethyldodeca-6,10-dienal
FR
verdyl acetate
FR
violet methyl carbonate
FR
ylang ylang flower oil III
FL/FR
fresh
3-(3-
propen-2-yl phenyl) butanal
FR
fruity
benzyl methyl ether
FL/FR
citronellyl isobutyrate
FL/FR
cyclohexyl crotonate
FR
dimethyl succinate
FL/FR
ethyl methyl-para-tolyl glycidate
FL/FR
peach pivalate
FR
tropical indene
FR
tropical ionone
FL/FR
fungal
jasmin nonane
FR
green
acetaldehyde methyl hexyl acetal
FR
iso
amyl 3-(2-furan) propionate
FL/FR
iso
butyl benzyl carbinol
FL/FR
iso
butyl heptanoate
FL/FR
iso
butyl methyl ketone
FL/FR
2-sec-
butyl thiazole
FL/FR
chrysanthemum oxide
FL/FR
decanal propylene glycol acetal
FL/FR
3,7-
dimethyl-6-octenoic acid
FL/FR
earthy acetal
FL/FR
fern fragrance
FR
flower hexene
FR
green cyclopropionate
FR
heptanal (aldehyde C-7)
FL/FR
(Z)-4-
hexen-1-ol
FL/FR
(Z)-3-
hexen-1-yl acetoacetate
FL/FR
(Z)-3-
hexen-1-yl angelate
FR
hexen-1-yl oxypropane nitrile
FR
(Z)-3-
hexen-1-yl tiglate
FL/FR
3-
hexenyl 2-methyl butyrate
FL/FR
hexyl (Z)-tiglate
FL/FR
hyacinth absolute
FL/FR
3,6-
ivy carbaldehyde
FL/FR
ivy carbaldehyde
FL/FR
ivy carbaldehyde / methyl anthranilate schiff's base
FR
ivy dioxolane
FR
english
ivy leaf absolute
FR
(2-
methoxy-1-methyl butyl) benzene
FR
[(4E,4Z)-5-
methoxy-3-methyl-4-penten-1-yl] benzene
FR
methyl cyclocitrone (IFF)
FR
para-
methyl hydratropaldehyde
FL/FR
methyl octine carbonate
FL/FR
6-
methyl-3-hepten-2-one
FL/FR
4-
methyl-4-phenyl pentanone
FR
nerol oxide
FL/FR
octanal dimethyl acetal
FL/FR
octyl oxyacetaldehyde
FR
pelargonium graveolens stem leaf extract
FR
phenyl acetaldehyde
FL/FR
phenyl acetaldehyde solution
FL/FR
seaweed absolute (fucus vesiculosus et serratus)
FL/FR
herbal
chrysanthemum ketone
FR
clary acetate
FR
clary sage absolute
FL/FR
coriander oleoresin
FL/FR
cis-
herbal cyclohexane
FR
herbal dioxane
FR
linalyl acetate
FL/FR
linalyl formate
FL/FR
2-
methyl butyl salicylate
FL/FR
(E)-6-
methyl-3-hepten-2-one
FL/FR
(1S,5R)-
myrtenyl acetate
FL/FR
nonisyl formate
FR
1-
octen-3-yl acetate
FL/FR
curled
parsley herb oil
FL/FR
perillaldehyde
FL/FR
phenyl acetaldehyde diisoamyl acetal
FR
tagete oil CO2 extract
FL/FR
tagete oil rwanda
FL/FR
tagete oil south africa
FL/FR
viridiflorol
FL/FR
marine
marine hexane
FR
medicinal
kunzea ericoides leaf oil
FR
minty
(-)-iso
pulegol
FL/FR
spicy
cinnamyl propionate
FL/FR
cuminaldehyde
FL/FR
iso
cyclogeraniol (IFF)
FR
spicy carbonate
FR
tea
camellia oleifera leaf extract
FL/FR
waxy
3-
decanone
FL/FR
woody
verdoxan
FR
For Flavor
No flavor group found for these
acetaldehyde dibutyl acetal
FL/FR
amyl benzoate
FL/FR
boronia concrete
FL/FR
iso
butyl heptanoate
FL/FR
2-sec-
butyl thiazole
FL/FR
4-
butyl thiazole
FL
decanal propylene glycol acetal
FL/FR
3-
decanone
FL/FR
(±)-2,3-
dihydrofarnesol
FL/FR
earthy acetal
FL/FR
ethyl 2-benzyl butyrate
FL/FR
ethyl 4-pentenoate
FL/FR
(Z)-3-
hexen-1-yl acetoacetate
FL/FR
hexyl (Z)-tiglate
FL/FR
hyacinth absolute
FL/FR
hydroxycitronellal propylene glycol acetal
FL/FR
ivy carbaldehyde
FL/FR
linalyl formate
FL/FR
linalyl phenyl acetate
FL/FR
2-
methyl butyl salicylate
FL/FR
6-
methyl-3-hepten-2-one
FL/FR
(E)-6-
methyl-3-hepten-2-one
FL/FR
phenyl acetaldehyde solution
FL/FR
propyl anthranilate
FL/FR
2-
propyl thiazole
FL
seaweed absolute (fucus vesiculosus et serratus)
FL/FR
styralyl formate
FL/FR
terpinyl isobutyrate
FL/FR
2-
tetradecenal
FL/FR
viridiflorol
FL/FR
iso
amyl 3-(2-furan) propionate
FL/FR
alpha-
butyl cinnamaldehyde
FL/FR
aldehydic
aldehydic
iso
butyraldehyde
FL/FR
amber
iso
butyl benzyl carbinol
FL/FR
aromatic
amyl salicylate
FL/FR
citrus
bergamot oil
FL/FR
bergamot oil bergaptene reduced italy
FL/FR
bergamot oil turkey
FL/FR
citral dimethyl acetal
FL/FR
nerol
FL/FR
fatty
2-
decenal
FL/FR
(E)-2-
octenal
FL/FR
floral
cinnamyl propionate
FL/FR
citronellyl acetate
FL/FR
citronellyl propionate
FL/FR
dihydrocarvyl acetate
FL/FR
dimethyl benzyl carbinyl butyrate
FL/FR
3,7-
dimethyl-6-octenoic acid
FL/FR
farnesol
FL/FR
farnesyl acetate
FL/FR
geranium oil
FL/FR
geranium oil africa
FL/FR
geranium oil bourbon
FL/FR
geranium oil egypt
FL/FR
geranyl acetone
FL/FR
(E)-
geranyl acetone
FL/FR
geranyl isobutyrate
FL/FR
linalyl acetate
FL/FR
muguet shiseol
FL/FR
neroli oil bigarde
FL/FR
neroli oil CO2 extract
FL/FR
ocean propanal
FL/FR
orange leaf absolute
FL/FR
bitter
orangeflower absolute tunisia
FL/FR
laevo-
rose oxide
FL/FR
tropical ionone
FL/FR
ylang ylang flower oil III
FL/FR
fruity
benzyl methyl ether
FL/FR
citronellyl isobutyrate
FL/FR
dimethyl succinate
FL/FR
ethyl methyl-para-tolyl glycidate
FL/FR
hexyl lactate
FL/FR
rhodinyl formate
FL/FR
rose butanoate
FL/FR
tagete oil CO2 extract
FL/FR
tagete oil rwanda
FL/FR
tagete oil south africa
FL/FR
green
iso
butyl methyl ketone
FL/FR
chrysanthemum oxide
FL/FR
clary sage absolute
FL/FR
coriander oleoresin
FL/FR
cuminyl acetaldehyde
FL/FR
geranyl formate
FL/FR
heptanal (aldehyde C-7)
FL/FR
(Z)-4-
hexen-1-ol
FL/FR
(Z)-3-
hexen-1-yl salicylate
FL/FR
(Z)-3-
hexen-1-yl tiglate
FL/FR
3-
hexenyl 2-methyl butyrate
FL/FR
3,6-
ivy carbaldehyde
FL/FR
methyl 2-undecynoate
FL
para-
methyl hydratropaldehyde
FL/FR
methyl octine carbonate
FL/FR
nerol oxide
FL/FR
nerolidol
FL/FR
(E)-
nerolidol
FL/FR
nonanal dimethyl acetal
FL/FR
octanal dimethyl acetal
FL/FR
1-
octen-3-yl acetate
FL/FR
papaya isobutyrate
FL/FR
phenyl acetaldehyde diisobutyl acetal
FL/FR
(Z)-
rose oxide
FL/FR
herbal
coriander seed oil CO2 extract
FL/FR
curled
parsley herb oil
FL/FR
honey
phenyl acetaldehyde
FL/FR
medicinal
dimethyl benzyl carbinol
FL/FR
melon
hydroxycitronellal diethyl acetal
FL/FR
minty
(-)-iso
pulegol
FL/FR
ripe
(E)-4-
decenal
FL/FR
soapy
dodecanal (aldehyde C-12 lauric)
FL/FR
spicy
cinnamyl formate
FL/FR
cuminaldehyde
FL/FR
perillaldehyde
FL/FR
tea
camellia oleifera leaf extract
FL/FR
waxy
alpha-
hexyl cinnamaldehyde
FL/FR
mimosa absolute
FL/FR
mimosa absolute france
FL/FR
mimosa absolute india
FL/FR
(E)-2-
tetradecenal
FL/FR
woody
(1S,5R)-
myrtenyl acetate
FL/FR
 
Potential Uses:
 deodorants
 odor eleminator
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
(2E)-2-butene dioic acid dihexyl ester
(E)-2-butene dioic acid dihexyl ester
2-butenedioic acid, dihexyl ester, (2E)-
 dihexyl (2E)-but-2-enedioate
 dihexyl (2E)but-2-ene-1,4-dioate
 dihexyl (E)-but-2-ene dioate
 dihexyl (E)-but-2-enedioate
(E)-dihexyl fumarate
 dihexyl trans-2-butene dioate
 dihexyl trans-butenedioate
(E)-fumaric acid dihexyl ester
 fumaric acid, dihexyl ester
 

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