(Z)-3-hexen-1-yl oxyacetaldehyde
cis-3-hexenyloxyacetaldehyde
 
Notes:
None found
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CAS Number: 68133-72-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 268-699-7
XlogP3-AA: 1.40 (est)
Molecular Weight: 142.19798000
Formula: C8 H14 O2
NMR Predictor: Predict (works with chrome or firefox)
Category: fragrance agents
 
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 96.00 to 100.00 % sum of isomers
Food Chemicals Codex Listed: No
Specific Gravity: 0.91000 to 0.93000 @  25.00 °C.
Pounds per Gallon - (est).: 7.572 to  7.739
Refractive Index: 1.43600 to 1.44600 @  20.00 °C.
Boiling Point: 75.00 °C. @ 20.00 mm Hg
Vapor Pressure: 0.924000 mmHg @ 25.00 °C. (est)
Vapor Density: >1 ( Air = 1 )
Flash Point: 170.00 °F. TCC ( 76.67 °C. )
logP (o/w): 1.197 (est)
Soluble in:
 alcohol
 water, 6248 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: green
 
Odor Strength: medium ,
recommend smelling in a 10.00 % solution or less
 
Substantivity: 216 hour(s) at 100.00 %
 
 fresh  watery  ozone  green  waxy  citrus  aldehydic  
Odor Description:
at 10.00 % in dipropylene glycol. 
fresh watery ozone green waxy citrus aldehydic
Luebke, William tgsc, (1989)
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
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Suppliers:
 None found
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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  4100 mg/kg
Food and Cosmetics Toxicology. Vol. 17, Pg. 801, 1979.

Dermal Toxicity:
skin-rabbit LD50 2350 mg/kg
Food and Cosmetics Toxicology. Vol. 17, Pg. 801, 1979.

Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: fragrance agents
Recommendation for (Z)-3-hexen-1-yl oxyacetaldehyde usage levels up to:
  4.0000 % in the fragrance concentrate.
 
Recommendation for (Z)-3-hexen-1-yl oxyacetaldehyde flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
EPA Substance Registry Services (TSCA): 68133-72-2
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 6437471
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 3
 2-[(Z)-hex-3-enoxy]acetaldehyde
Chemidplus: 0068133722
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References:
 2-[(Z)-hex-3-enoxy]acetaldehyde
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 68133-72-2
Pubchem (cid): 6437471
Pubchem (sid): 135065864
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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
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
No odor group found for these
(Z)-verbenolFL/FR
(E)-verbenolFL/FR
aldehydic
 acetyl nonyrylFL/FR
 adoxal (Givaudan)FL/FR
 citronellyl oxyacetaldehydeFL/FR
9-decenalFL/FR
 dodecanal (aldehyde C-12 lauric)FL/FR
(Z)-4-dodecenalFL/FR
 geranyl oxyacetaldehydeFR
 mandarine undecenalFL/FR
2-methyl undecanal dimethyl acetalFR
3-methyl-4-(1-methyl hexyl oxy) butyraldehydeFR
3-methyl-4-heptyl oxybutyraldehydeFR
 nonanal (aldehyde C-9)FL/FR
 octanal (aldehyde C-8)FL/FR
 octane nitrileFR
 TMH aldehydeFR
N-/i-undecanalFR
8-undecenalFR
(Z)-8-undecenalFR
 undecenal mixture (aldehyde C-11 mixed)FL/FR
balsamic
isoamyl benzoateFL/FR
 verbenolFL/FR
citrus
 aldenal C-10FR
 citronellyl nitrileFR
 citrus limon peel oil expressedFL/FR
 citrus paradisi peel extractFL/FR
 curacao specialtyFR
(E)-4-decenalFL/FR
(Z)-7-decenalFR
(Z)-4-decenalFL/FR
 lemon oil c.p. californiaFL/FR
 lemon oil c.p. furocoumarin reducedFL/FR
 lime octadienalFR
 mandarin specialtyFR
 marine decadienalFR
2-methyl decanal (aldehyde C-11 MOA)FL/FR
 myrmac aldehydeFR
 orange fruit oilFL/FR
blood orange oil italyFL/FR
2-tetradecenalFL/FR
(E)-2-tetradecenalFL/FR
 tetrahydrocitralFL/FR
10-undecen-1-olFL/FR
 waxy nitrileFR
creamy
3-heptyl dihydro-5-methyl-2(3H)-furanoneFL/FR
fatty
(E,E)-2,4-decadien-1-olFL/FR
2,4-decadien-1-olFL/FR
2-nonenalFL/FR
(E)-2-nonenalFL/FR
floral
 citronellalFL/FR
 cyclohexyl ethyl alcoholFL/FR
 geraniolFL/FR
 hexyl 2-furoateFL/FR
 hydroxycitronellalFL/FR
 hydroxycitronellal dimethyl acetalFL/FR
 methyl citronellateFL/FR
 muguet butanalFR
 muguet carboxaldehydeFR
 muguet nitrileFR
 nerolidolFL/FR
 nerolidyl acetateFL/FR
3-nonanon-1-yl acetateFL/FR
 ocean propanalFL/FR
 ocean propanal / methyl anthranilate schiff's baseFR
 phenethyl hexanoateFL/FR
fresh
 decyl vinyl etherFR
fruity
 amyl hexanoateFL/FR
isoamyl octanoateFL/FR
 butyl hexanoateFL/FR
 cyclohexyl propionateFL/FR
 hexanal propylene glycol acetalFL/FR
2-methyl butyl 2-methyl butyrateFL/FR
 methyl heptanoateFL/FR
(E)-2-nonen-1-yl acetateFL/FR
(E)-2-undecenalFL/FR
green
 cilantro leaf oilFL/FR
 cumin acetaldehydeFL/FR
isocyclocitral (IFF)FL/FR
 dodecanal dimethyl acetalFL/FR
 ethyl (E,Z)-2,4-decadienoateFL/FR
 fresh nitrileFR
 green carbaldehydeFR
 green heptenalFR
 heptanal (aldehyde C-7)FL/FR
 heptyl formateFL/FR
(Z)-3-hexen-1-yl formateFL/FR
(Z)-3-hexen-1-yl hexanoateFL/FR
 hexyl 2-methyl butyrateFL/FR
 hexyl octanoateFL/FR
 hexyl phenyl acetateFL/FR
 melon nonenoateFL/FR
 neryl butyrateFL/FR
3,6-nonadien-1-yl acetateFL/FR
(E,Z)-3,6-nonadien-1-yl acetateFL/FR
(E)-3-nonen-1-olFL/FR
 phenoxyacetaldehyde 50% in benzyl alcoholFR
 phenoxyacetaldehyde 50% in peomosaFR
 phenyl acetaldehyde ethylene glycol acetalFR
hay
para-methyl phenoxyacetaldehydeFR
herbal
2-cyclohexyl cyclohexanoneFR
 floral nitrileFR
6-methoxy-2,6-dimethyl octanalFR
3-octyl acetateFL/FR
 savin wood oil (juniperus phoenicea)FL/FR
marine
 marine carbonitrileFR
 marine hexaneFR
 marine pyridineFR
 ocean carboxaldehydeFR
 ozone propanalFR
melon
 melon heptenalFL/FR
spicy
 myristica fragrans fruit extractFL/FR
 myristica fragrans seed tinctureFL/FR
waxy
 aldenal C-9FR
 decanal diethyl acetalFL/FR
9-decenoic acidFL/FR
 ethyl laurateFL/FR
 hexadecanolFL/FR
(E)-methyl geranateFL/FR
2-methyl heptanoic acidFL/FR
 methyl octanoateFL/FR
(Z)-nerolidol 
2-nonanolFL/FR
(Z)-3-nonen-1-olFL/FR
 octanolFL/FR
 octyl isobutyrateFL/FR
 phenethyl octanoateFL/FR
 waxy undecadienolFR
woody
 woody hepteneFR
 
For Flavor
 
No flavor group found for these
9-decenalFL/FR
(Z)-4-dodecenalFL/FR
 mandarine undecenalFL/FR
(E)-methyl geranateFL/FR
(Z)-nerolidol 
 nerolidyl acetateFL/FR
(E)-3-nonen-1-olFL/FR
 savin wood oil (juniperus phoenicea)FL/FR
2-tetradecenalFL/FR
 tetrahydrocitralFL/FR
10-undecen-1-olFL/FR
 undecenal mixture (aldehyde C-11 mixed)FL/FR
(E)-verbenolFL/FR
(Z)-verbenolFL/FR
aldehydic
 acetyl nonyrylFL/FR
 nonanal (aldehyde C-9)FL/FR
 octanal (aldehyde C-8)FL/FR
citrus
 cilantro leaf oilFL/FR
 citronellyl oxyacetaldehydeFL/FR
 citrus limon peel oil expressedFL/FR
 citrus paradisi peel extractFL/FR
(Z)-4-decenalFL/FR
 lemon oil c.p. californiaFL/FR
 lemon oil c.p. furocoumarin reducedFL/FR
2-methyl decanal (aldehyde C-11 MOA)FL/FR
 orange fruit oilFL/FR
blood orange oil italyFL/FR
creamy
 octyl isobutyrateFL/FR
fatty
(E,E)-2,4-decadien-1-olFL/FR
2,4-decadien-1-olFL/FR
 heptyl formateFL/FR
2-nonenalFL/FR
floral
 citronellalFL/FR
 geraniolFL/FR
 methyl citronellateFL/FR
 ocean propanalFL/FR
fruity
isoamyl benzoateFL/FR
 amyl hexanoateFL/FR
isoamyl octanoateFL/FR
 butyl hexanoateFL/FR
 cyclohexyl propionateFL/FR
3-heptyl dihydro-5-methyl-2(3H)-furanoneFL/FR
 hexanal propylene glycol acetalFL/FR
 hexyl phenyl acetateFL/FR
2-methyl butyl 2-methyl butyrateFL/FR
 methyl heptanoateFL/FR
3-nonanon-1-yl acetateFL/FR
 phenethyl octanoateFL/FR
green
 cumin acetaldehydeFL/FR
isocyclocitral (IFF)FL/FR
 cyclohexyl ethyl alcoholFL/FR
 dodecanal dimethyl acetalFL/FR
 ethyl (E,Z)-2,4-decadienoateFL/FR
 heptanal (aldehyde C-7)FL/FR
(Z)-3-hexen-1-yl formateFL/FR
(Z)-3-hexen-1-yl hexanoateFL/FR
 hexyl 2-furoateFL/FR
 hexyl 2-methyl butyrateFL/FR
 hexyl octanoateFL/FR
 melon heptenalFL/FR
 melon nonenoateFL/FR
 methyl octanoateFL/FR
 nerolidolFL/FR
 neryl butyrateFL/FR
(E,Z)-3,6-nonadien-1-yl acetateFL/FR
3,6-nonadien-1-yl acetateFL/FR
(E)-2-nonenalFL/FR
3-octyl acetateFL/FR
herbal
 verbenolFL/FR
ripe
(E)-4-decenalFL/FR
soapy
 dodecanal (aldehyde C-12 lauric)FL/FR
spicy
 myristica fragrans fruit extractFL/FR
 myristica fragrans seed tinctureFL/FR
waxy
 adoxal (Givaudan)FL/FR
 decanal diethyl acetalFL/FR
9-decenoic acidFL/FR
 ethyl laurateFL/FR
 hexadecanolFL/FR
 hydroxycitronellalFL/FR
 hydroxycitronellal dimethyl acetalFL/FR
2-methyl heptanoic acidFL/FR
2-nonanolFL/FR
(Z)-3-nonen-1-olFL/FR
(E)-2-nonen-1-yl acetateFL/FR
 octanolFL/FR
 phenethyl hexanoateFL/FR
(E)-2-tetradecenalFL/FR
(E)-2-undecenalFL/FR
 
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Potential Uses:
 aldehydicFR
 citrusFR
 cucumberFR
 floralFR
 fresh and cleanFR
 greenFR
 herbalFR
 ozone 
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 acetaldehyde, ((3Z)-3-hexenyloxy)-
 acetaldehyde, (3-hexenyloxy)-, (Z)-
2-[(Z)-hex-3-enoxy]acetaldehyde
(Z)-(3-hexen-1-yl oxy) acetaldehyde
(Z)-3-hexen-1-yl oxyacetaldehyde
cis-3-hexen-1-yl oxyacetaldehyde
cis-3-hexenyl oxy acetaldehyde
(Z)-3-hexenyl oxyacetaldehyde
cis-hexenyl oxyacetaldehyde
cis-3-hexenyl oxyacetaldehyde
(Z)-(3-hexenyloxy)acetaldehyde
cis-3-hexenyloxyacetaldehyde
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Articles:
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