2-octen-1-ol
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IUPAC name :oct-2-en-1-ol
InChI :InChI=1/C8H16O/c1-2-3-4-5-6-7-8-9/h6-7,9H,2-5,8H2,1H3
InChIKey :AYQPVPFZWIQERS-UHFFFAOYAP
SMILES :CCCCCC=CCO
cas number :22104-78-5
fema number :3887
coe number :11804
fl. number :02.192
molar refractivity :40.70 ± 0.3 cm3
parachor :354.3 ± 4.0 cm3
index of refraction :1.449 ± 0.02
surface tension :29.7 ± 3.0 dyne/cm
density :0.845 ± 0.06 g/cm3
polarizability :16.13 ± 0.5 10-24cm3
XlogP : 2.80
molecular weight : 128.2120400 (IUPAC)
formula :C8 H16 O
NMR Predictor :Predict
 
 
export tariff code :2905.29.9000
fda reg :unspecified
Suppliers :
Bedoukian Research :trans-2-OCTEN-1-OL
≥96.0% (trans), Kosher
Odor:  green, vegetable-like
Lends a pleasant, fatty note to fruity complexes.
Flavor:  green
Can be used in berry, citrus, cucumber and dairy flavors such as sour cream and cream cheese, as well as in cheese and fish applications.
organoleptics :
odor strength :high ,
recommend smelling in a 1.00 % solution or less
odor description:
at 1.00 % in dipropylene glycol.  		green vegetable
properties :
appearence :colorless clear liquid
assay : 96.00 to 100.00 %   sum of isomers
Food Chemicals Codex Listed :No
boiling point : 195.00 to 196.00 °C. @ 760.00 mm Hg
flash point : 172.00  °F.  TCC  ( 77.78 °C. )
logP (o/w) : 2.82
safety :
most important hazard(s) :Xi - Irritant
  R 36/37/38 - Irritating to eyes, respiratory system, and skin.
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 37/39 - Wear suitable gloves and eye/face protection.
Oral Toxicity(LD50) : 
  Not determined
Dermal Toxicity(LD50) : 
  Not determined
Inhalation Toxicity(LC50) : 
  Not determined
 
safety in use :
Category :flavor and fragrance agents
 
recommendation for 2-octen-1-ol fragrance usage levels up to :
  1.0000 % in the fragrance concentrate.
safety references :
EPI System :view
 
WGK Germany :3
 
 
 
 
oct-2-en-1-ol
chemidplus :022104785
EPA Substance Registry Services :22104-78-5
references :
 
oct-2-en-1-ol
fl. number :02.192
NIST Chemistry WebBook :22104785
pubchem :667478
other :
VCF-Online: VCF Volatile Compounds in Food
synonyms :
 oct-2-en-1-ol
2-octenol-1
soluble in :
 alcohol
insoluble in :
 water
potential blenders :    note
 citral diethyl acetalFL/FR
 citronellyl butyrateFL/FR
(E,E,Z)-2,4,7-decatrien-1-alFL
2,4,7-decatrien-1-alFL
 green hexanalFL/FR
(Z)-3-hexen-1-yl oxyacetaldehydeFR
 linalyl acetateFL/FR
dextro-linalyl acetateFL/FR
laevo-linalyl acetateFL/FR
 melon heptenal propylene glycol acetalFL/FR
 nerolidolFL/FR
(E)-nerolidolFL/FR
 octanal diethyl acetalFL/FR
(E)-2-octen-1-olFL/FR
 tangerine acetateFR
potential uses :
 berry
 citrus
 vegetable
natural occurrence in :    note
data pagementha longifolia (l.) huds. oil jordan @ trace% S

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