(E)-2-octen-1-yl butyrate
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :[(E)-oct-2-enyl] butanoate
InChI :InChI=1/C12H22O2/c1-3-5-6-7-8-9-11-14-12(13)10-4-2/h8-9H,3-7,10-11H2,1-2H3/b9-8+
InChIKey :GPINUUWEKPNDBB-CMDGGOBGBL
SMILES :CCCCC\C=C\COC(=O)CCC
(EINECS) number :283-437-1
cas number :84642-60-4
fema number :3517
coe number :11907
jecfa number :1368
fl. number :09.277
molar refractivity :59.47 ± 0.3 cm3
parachor :521.5 ± 4.0 cm3
index of refraction :1.444 ± 0.02
surface tension :29.5 ± 3.0 dyne/cm
density :0.886 ± 0.06 g/cm3
polarizability :23.57 ± 0.5 10-24cm3
xlogp : 4.40
molecular weight : 198.3018800
formula :C12 H22 O2
 
 
fda reg :unspecified h. number :2915.60.0000
organoleptics : 
odor type :waxy
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description :
at 10.00 % in dipropylene glycol.  
waxy fruity berry
properties : 
appearence :colorless clear liquid
assay : 94.00 - 100.00 %   sum of isomers
Food Chemicals Codex Listed :No
boiling point : 254.00 - 255.00 °C. @ 760.00 mm Hg
logp : 4.71
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 225.00  °F.  TCC  ( 107.22 °C. )
  
recommendation for (E)-2-octen-1-yl butyrate usage levels up to :
  1.0000 % in the fragrance concentrate.
  
safety links : 
(EINECS) number :283-437-1
chemidplus :084642604
epa-srs :84642-60-4
  
other : 
 
references : 
jecfa number :1368
fl. number :09.277
pubchem :199597
  
synonyms :
(E)-2-octen-1-yl butanoate
trans-2-octen-1-yl butanoate
(E)-2-octen-1-yl butyrate
trans-2-octen-1-yl butyrate
(E)-2-octenyl butyrate
trans-2-octenyl butyrate
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) blends with :
 acetaldehyde methyl hexyl acetal
 acetoin butyrate
 acetyl methyl anthranilate
 allyl benzoate
 allyl heptanoate
 allyl nonanoate
 allyl octanoate
 allyl tiglate
 ambrette seed absolute
delta6-isoambrettolide
isoamyl 2-methyl butyrate
isoamyl isobutyrate
para-anisyl propanal
 artemisyl ketone
 benzyl butyrate
3-benzyl-4-heptanone
 berry hexanoate
 berry pentadienoate
 bisabolene
 blackberry thiophenone
 bornyl valerate
 buchu mercaptan
 butyl anthranilate
isobutyl anthranilate
isobutyl butyrate
 butyl hexanoate
isobutyl isovalerate
 butyl valerate
isobutyl-3-(methyl thio) butyrate
 campholene acetate
alpha-campholenic alcohol
 conifer acetate
ortho-cresyl isobutyrate
 cyclohexyl ethyl acetate
beta-damascenone
alpha-damascone
 davana oil
3-decanone
(Z)-4-decen-1-ol
 decyl butyrate
 dihydro-alpha-ionone
isodihydrolavandulal
(E,E)-2,4-dodecadien-1-ol
 ethyl (E)-2-decenoate
 ethyl (E)-4-decenoate
 ethyl 2-hydroxy-3-methyl valerate
 ethyl 2-methyl-2-pentenoate
 ethyl 3-oxohexanoate
2-ethyl butyric acid
 ethyl cinnamate
 ethyl decanoate
 ethyl levulinate
 ethyl maltol
 ethyl methyl-para-tolyl glycidate
 ethyl ortho-anisate
 ethyl palmitate
 ethyl undecylenate
 ethyl valerate
 filbert hexenone
 fir balsam absolute
 fruity ketal
 furfuryl isovalerate
1-furfuryl pyrrole
(E)-furfurylidene phenyl acetaldehyde
(E)-geranyl acetone
 geranyl butyrate
 geranyl hexanoate
 geranyl isovalerate
 heliotropyl acetate
 heliotropyl acetone
 heliotropyl isobutyrate
 herbal undecanone
3-hexanone
(Z)-3-hexen-1-yl 2-methyl butyrate
(Z)-3-hexen-1-yl 2-methyl-2-pentenoate
(E)-2-hexen-1-yl acetate
(Z)-3-hexen-1-yl hexanoate
(Z)-3-hexen-1-yl propionate
 hexyl 2-methyl butyrate
 hexyl isobutyrate
 hexyl isovalerate
 hexyl octanoate
 hexyl phenyl acetate
 hyacinth ether
beta-ionone
beta-ionone epoxide
beta-ionyl acetate
 jasmin absolute
 juniperberry oleoresin
 leather propionate
 maltyl isobutyrate
 maltyl propionate
 mango thiol
dextro,laevo-menthyl acetate
 methyl (E)-cinnamate
 methyl 2-methyl valerate
 methyl 2-undecynoate
 methyl 2,4-decadienoate
 methyl beta-ionol
 methyl butyl phenyl acetate
 methyl cinnamate
 methyl citronellate
 methyl furfuryl disulfide
 methyl heptanoate
 methyl propionate
 methyl undecanoate
2-methyl-2-pentenoic acid
2-methyl-3-pentenoic acid
 nerolin fragarol
 neryl isobutyrate
(E)-2-nonen-1-yl acetate
3-nonen-2-one
(E)-2-octen-1-yl acetate
3-octen-2-one
(E)-2-octen-4-ol
 octyl 2-methyl butyrate
 octyl propionate
 orris root resinoid
 osmanthus absolute
 phenethyl butyrate
2-phenethyl isothiocyanate
 phenethyl pivalate
3-phenyl propyl isovalerate
 phenyl propyl valerate
 phytyl acetate
isopropenyl acetate
 propyl acetate
 propyl formate
 propyl heptanoate
isopropyl hexanoate
 propyl isobutyrate
 prune glycidate
 raspberry ketone
 raspberry ketone acetate
 raspberry ketone methyl ether
 rose carboxylate
 strawberry furanone
 strawberry glycidate 1
 strawberry glycidate 2
 styralyl butyrate
 tetrahydroionyl acetate
 thiogeraniol
4-(para-tolyl)-2-butanone
(E)-2-tridecen-1-yl acetate
 tropical trithiane
2-undecanone
 vanilla carboxylate
(odor and/or flavor) used in :
 berry
 butter
 fruit
 waxy
natural occurrence in :
not found in nature



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