(Z)-2-hexen-1-ol
Notes :
Fresh green topnotes.
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :hex-2-en-1-ol
InChI :InChI=1/C6H12O/c1-2-3-4-5-6-7/h4-5,7H,2-3,6H2,1H3
InChIKey :ZCHHRLHTBGRGOT-UHFFFAOYAD
SMILES :CCCC=CCO
(EINECS) number :218-972-1
cas number :2305-21-7
% from :98.00% to 100.00%
fema number :2562
coe number :69
jecfa number :1354
fl. number :02.157
molar refractivity :31.43 ± 0.3 cm3
parachor :274.8 ± 4.0 cm3
index of refraction :1.442 ± 0.02
surface tension :28.7 ± 3.0 dyne/cm
density :0.843 ± 0.06 g/cm3
polarizability :12.46 ± 0.5 10-24cm3
xlogp : 1.70
molecular weight : 100.1588800
formula :C6 H12 O
BioActivity Analysis :427685
 
 
IUPAC name :(Z)-hex-2-en-1-ol
InChI :InChI=1/C6H12O/c1-2-3-4-5-6-7/h4-5,7H,2-3,6H2,1H3/b5-4-
InChIKey :ZCHHRLHTBGRGOT-PLNGDYQABY
SMILES :CCC\C=C/CO
(EINECS) number :213-190-7
cas number :928-94-9
% from :90.00% to 98.00%
fema number :3924
coe number :69
jecfa number :1374
fl. number :02.156
molar refractivity :31.43 ± 0.3 cm3
parachor :274.8 ± 4.0 cm3
index of refraction :1.442 ± 0.02
surface tension :28.7 ± 3.0 dyne/cm
density :0.843 ± 0.06 g/cm3
polarizability :12.46 ± 0.5 10-24cm3
xlogp : 1.70
molecular weight : 100.1588800
formula :C6 H12 O
 
 
IUPAC name :(E)-hex-2-en-1-ol
InChI :InChI=1/C6H12O/c1-2-3-4-5-6-7/h4-5,7H,2-3,6H2,1H3/b5-4+
InChIKey :ZCHHRLHTBGRGOT-SNAWJCMRBF
SMILES :CCC\C=C\CO
(EINECS) number :213-191-2
cas number :928-95-0
% from :0.10% to 8.00%
beilstein number :1719709
fema number :2562
coe number :69
molar refractivity :31.43 ± 0.3 cm3
parachor :274.8 ± 4.0 cm3
index of refraction :1.442 ± 0.02
surface tension :28.7 ± 3.0 dyne/cm
density :0.843 ± 0.06 g/cm3
polarizability :12.46 ± 0.5 10-24cm3
xlogp : 1.70
molecular weight : 100.1588800
formula :C6 H12 O
 
 
fda reg :unspecified h. number :2905.29.9000
organoleptics : 
odor type :green
odor strength :high ,
recommend smelling in a 10.00 % solution or less
odor description :
at 10.00 % in dipropylene glycol.  		fresher than the trans-2-hexenol green leafy fruity
taste description³ :at 5.00 - 50.00 ppm.  
Green vegetative and herbal, raw green beans, tomato and potato with a fusel winey nuance
properties : 
appearence :colorless clear liquid
assay : 98.00 - 100.00 %   sum of isomers
Food Chemicals Codex Listed :No
specific gravity :0.84500 - 0.85300 @ 25.00 °C.
pounds per gallon - calc. : 7.031 to 7.098
refractive index :1.43700 - 1.44500 @ 20.00 °C.
boiling point : 166.00 °C. @ 760.00 mm Hg
boiling point : 65.00 °C. @ 0.50 mm Hg
logp : 1.61
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 158.00  °F.  TCC  ( 70.00 °C. )
  
recommendation for (Z)-2-hexen-1-ol usage levels up to :
  0.5000 % in the fragrance concentrate.
  
recommendation for (Z)-2-hexen-1-ol usage levels up to :
  50.0000 ppm in the flavor.
  
safety links : 
(EINECS) number :218-972-1
chemidplus :002305217
epa-srs :2305-21-7
dtp/nci :142553
  
(EINECS) number :213-190-7
chemidplus :000928949
epa-srs :928-94-9
  
(EINECS) number :213-191-2
rtecs :MP8390000 for 928-95-0
chemidplus :000928950
epa-srs :928-95-0
  
other : 
 
references : 
jecfa number :1354
fl. number :02.157
pubchem :197560
  
jecfa number :1374
fl. number :02.156
pubchem :212420
NIST Chemistry WebBook :971624605
  
pubchem :156915
NIST Chemistry WebBook :3753858269
  
reference : Mosciano, Gerard P&F 25, No. 5, 72, (2000)³
synonyms :
(Z)-hex-2-en-1-ol
cis-hex-2-en-1-ol
(2Z)-2-hexen-1-ol
(Z)-2-hexen-1-ol
cis-2-hexen-1-ol
(Z)-2-hexenol
cis-2-hexenol
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) blends with :
alpha-benzylidene methional
 dihydroxyacetophenone
 dodecanal dimethyl acetal
 epoxy-2-decenal
2-ethyl-4,5-dimethyl oxazole
 furfuryl hexanoate
 grapefruit menthane
 guaiyl acetate
 heptanal cyclic propylene acetal
3-heptanone
(E)-2-hepten-1-al
(Z)-4-hepten-1-al
2-hepten-1-al
2-heptyl furan
 hexanal
(E)-4-hexen-1-al
4-hexen-1-ol
(Z)-3-hexen-1-yl (E)-crotonate
 hexyl (E)-2-hexenoate
alpha-hexyl cinnamaldehyde dimethyl acetal
2-methyl thiazole
4-(methyl thio) butanol
3-(methyl thio) hexanol
3-(5-methyl-2-furyl) butanal
(E,Z)-2,6-nonadien-1-al
(Z)-6-nonen-1-ol
(E,E)-2,4-octadien-1-al
2-octen-1-ol
(E)-2-octen-1-yl acetate
 octen-1-yl cyclopentanone
1-penten-3-ol
2-propyl pyrazine
isopropyl tiglate
2-isopropyl-3-(methyl thio) pyrazine
 propylene glycol acetone ketal
 reseda acetal
3-tetrahydrothiophenone
 tropical thiazole
 undecanal
(odor and/or flavor) used in :
 apple
 bean
 blueberry
 cherry
 cognac
 currant black currant
 fruit
 green
 leaf
 papaya
 peach
 pear
 pepper bell pepper
 potato
 tea
 tomato
 topnotes
 tropical
natural occurrence in :
apple
blueberry
butter
cherry sour cherry
cognac
currant black currant
data pageguava leaf oil cuba @ trace%
hop oil
papaya
peach
data pagestar fruit oil cuba @ trace%
tea black tea
tomato
wine red wine
wine white wine



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