cinnamyl valerate
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IUPAC name :[(E)-3-phenylprop-2-enyl] pentanoate
InChI :InChI=1/C14H18O2/c1-2-3-11-14(15)16-12-7-10-13-8-5-4-6-9-13/h4-10H,2-3,11-12H2,1H3/b10-7+
InChIKey :FLSKWIBFXUNBAW-JXMROGBWBP
SMILES :CCCCC(=O)OC\C=C\C1=CC=CC=C1
cas number :10482-65-2
(EINECS) number :233-987-3
molar refractivity :67.08 ± 0.3 cm3
parachor :533.8 ± 4.0 cm3
index of refraction :1.532 ± 0.02
surface tension :37.0 ± 3.0 dyne/cm
density :1.008 ± 0.06 g/cm3
polarizability :26.59 ± 0.5 10-24cm3
XlogP : 3.90
molecular weight : 218.2915200
formula :C14 H18 O2
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified
Suppliers :
Inoue :CINNAMYL VALERATE
organoleptics :
properties :
assay : 98.00 to 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 328.00 to 329.00 °C. @ 760.00 mm Hg
flash point : 269.00  °F.  TCC  ( 131.67 °C. )
logP (o/w) : 4.21
safety :
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 
safety in use :
 
safety references :
EPI System :view
Canada Domestic Sub. List :Yes
 
 
 
 [(E)-3-phenylprop-2-enyl] pentanoate
(EINECS) number :233-987-3
chemidplus :010482652
EPA Substance Registry Services :10482-65-2
references :
 [(E)-3-phenylprop-2-enyl] pentanoate
pubchem :689380
other :
synonyms :
 pentanoic acid 3-phenyl-2-propenyl ester
[(E)-3-phenylprop-2-enyl] pentanoate
soluble in :
 alcohol
insoluble in :
 water
natural occurrence in :
not found in nature



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