hexadecane
 
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IUPAC name :hexadecane
InChI :InChI=1/C16H34/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3-16H2,1-2H3
InChIKey :DCAYPVUWAIABOU-UHFFFAOYAR
SMILES :CCCCCCCCCCCCCCCC
(EINECS) number :208-878-9
cas number :544-76-3
beilstein number :1736592
fl. number :01.072
molar refractivity :76.17 ± 0.3 cm3
parachor :668.7 ± 4.0 cm3
index of refraction :1.433 ± 0.02
surface tension :27.2 ± 3.0 dyne/cm
density :0.773 ± 0.06 g/cm3
polarizability :30.19 ± 0.5 10-24cm3
xlogp : 7.80
molecular weight : 226.4411600
formula :C16 H34
BioActivity Analysis :73234
 
 
fda reg :unspecified h. number :2901.10.5000
organoleptics : 
properties : 
assay : 96.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.77300 @ 25.00 °C.
melting point : 18.00 - 20.00 °C. @ 760.00 mm Hg
boiling point : 286.00 - 287.00 °C. @ 760.00 mm Hg
logp : 8.25
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 275.00  °F.  TCC  ( 135.00 °C. )
  
safety links : 
(EINECS) number :208-878-9
rtecs :ML9200000 for 544-76-3
chemidplus :000544763
epa-srs :544-76-3
dtp/nci :7334
  
other : 
 
references : 
pubchem :154310
NIST Chemistry WebBook :1125617063
  
synonyms :
 cetane
N-cetane
 hexadecane
N-hexadecane
soluble in :
 alcohol
insoluble in :
 water
natural occurrence in :
data pageboronia absolute @ 0.04%
data pagecarnation absolute @ 0.05%
data pagedialium guineense wild.fruit oil france @ 6.30%
data pagegrapefruit oil c.p. russia @ 0.01%
data pagegrapefruit oil c.p. russia @ 0.01%
data pageherniaria incana lam. oil greece @ 0.30%
data pagejasmin absolute china @ 0.13%
data pageketaki flower oil india @ 0.20%
data pagelavender oil france @ 0.10%
data pagenarcissus absolute @ 0.03%
data pagethyme oil red CO2 extract @ 0.10%
data pageulva rigida oil greece @ 2.00%
data pagewitch hazel leaf oil @ 0.07%



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