butyl oleate
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IUPAC name :butyl (Z)-octadec-9-enoate
InChI :InChI=1/C22H42O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(23)24-21-6-4-2/h12-13H,3-11,14-21H2,1-2H3/b13-12-
InChIKey :WIBFFTLQMKKBLZ-SEYXRHQNBK
SMILES :CCCCCCCC/C=C\CCCCCCCC(=O)OCCCC
cas number :142-77-8
(EINECS) number :205-559-6
coe number :741
fl. number :09.208
molar refractivity :105.80 ± 0.3 cm3
parachor :919.3 ± 4.0 cm3
index of refraction :1.456 ± 0.02
surface tension :31.2 ± 3.0 dyne/cm
density :0.870 ± 0.06 g/cm3
polarizability :41.94 ± 0.5 10-24cm3
XlogP : 8.20
XlogP3-AA : 8.80
molecular weight : 338.5676800 (IUPAC)
formula :C22 H42 O2
NMR Predictor :Predict
 
 
export tariff code :2916.15.5000
fda reg :unspecified

Suppliers :
Inoue :BUTYL OLEATE
Pfaltz & Bauer :Butyl Oleate
Sigma-Aldrich-Sigma :Butyl oleate
practical grade, ~75%

organoleptics :
odor strength :low
odor description:
at 100.00 %.  
mild fatty

properties :
appearence :pale yellow clear liquid
assay : 75.00 to 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 220.00 to 222.00 °C. @ 760.00 mm Hg
boiling point : 228.00 °C. @ 15.00 mm Hg
flash point :> 200.00  °F.  TCC  ( > 93.33 °C. )
logP (o/w) : 9.75
shelf life : 12.00 month(s) or longer if stored properly.

safety :
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.
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 

safety in use :
 
recommendation for butyl oleate fragrance usage levels up to :
  10.0000 % in the fragrance concentrate.

safety references :
EPI System :view
NLM Hazardous Substances Data Bank :search
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :1
 
 
 
 
butyl (Z)-octadec-9-enoate
(EINECS) number :205-559-6
RTECS :RG3711000 for cas# 142-77-8
chemidplus :000142778
EPA Substance Registry Services :142-77-8
dtp/nci :6700

references :
 
butyl (Z)-octadec-9-enoate
fl. number :09.208
NIST Chemistry WebBook :2767677588
pubchem :152050

Cosmetics :
Cosmetic uses : emollients
masking agents
skin conditioning

other :
CosIng :cosmetic data
synonyms :
 butyl (Z)-9-octadecenoate
 butyl (Z)-octadec-9-enoate
 butyl cis-9-octadecenoate

soluble in :
 alcohol
 water, 0.0000572 mg/L @ 25C

insoluble in :
 water

potential uses :
 emollients
 skin conditioning

natural occurrence in :
 not found in nature  



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