tetradecanal
 
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IUPAC name :tetradecanal
InChI :InChI=1/C14H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h14H,2-13H2,1H3
InChIKey :UHUFTBALEZWWIH-UHFFFAOYAK
SMILES :CCCCCCCCCCCCCC=O
(EINECS) number :204-692-7
cas number :124-25-4
beilstein number :1765987
fema number :2763
coe number :118
jecfa number :112
fl. number :05.032
molar refractivity :67.09 ± 0.3 cm3
parachor :598.0 ± 4.0 cm3
index of refraction :1.435 ± 0.02
surface tension :29.3 ± 3.0 dyne/cm
density :0.826 ± 0.06 g/cm3
polarizability :26.59 ± 0.5 10-24cm3
xlogp : 5.60
molecular weight : 212.3715200
formula :C14 H28 O
BioActivity Analysis :111495
 
 
fda reg :172.515 h. number :unspecified
organoleptics : 
odor type :waxy
odor strength :medium
odor description :
at 100.00 %.  
fatty waxy amber incense dry citrus peel
taste description³ :at 10.00 ppm.  
Fatty, lactonic, coconut, woody and fishy with a fruity nuance
substantivity :400  Hour(s)
properties : 
appearence :colorless to pale yellow solid
assay : 92.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.82500 - 8.30000 @ 25.00 °C.
pounds per gallon - calc. : 6.865 to 69.064
refractive index :1.43800 - 1.44500 @ 20.00 °C.
melting point : 20.00 - 21.00 °C. @ 760.00 mm Hg
boiling point : 166.00 °C. @ 24.00 mm Hg
boiling point : 260.00 °C. @ 760.00 mm Hg
acid value : 15.00  max.  KOH/g
logp : 6.22
safety : 
most important hazard(s) : Xi - Irritant
  
Oral Toxicity(LD50) : Oral-Rat    >5.00  gm/kg    
Dermal Toxicity(LD50) : Skin-Rabbit  >10.00  gm/kg    
  
flash point ( Deg. F. ) : 230.00  °F.  TCC  ( 110.00 °C. )
  
recommendation for tetradecanal usage levels up to :
  1.0000 % in the fragrance concentrate.
  
recommendation for tetradecanal usage levels up to :
  20.0000 ppm in the flavor.
  
safety links : 
(EINECS) number :204-692-7
chemidplus :000124254
epa-srs :124-25-4
dtp/nci :66435
  
other : 
 
references : 
pubchem :173344
NIST Chemistry WebBook :3219471309
  
reference : Mosciano, Gerard P&F 22, No. 3, 47, (1997)³
synonyms :
 aldehyde C-14 myristic
 myristaldehyde
 myristic aldehyde
 myristyl aldehyde
 tetradecanal
1-tetradecanal
N-tetradecanal
 tetradecyl aldehyde
 tetradecylaldehyde
soluble in :
 alcohol
 dipropylene glycol
insoluble in :
 water
(odor and/or flavor) blends with :
 ambroxan
 amyris wood oil
 animal carbolactone
para-anisaldehyde
 anise seed oil
para-anisyl alcohol - fixer
 anthocephalus cadamba oil
 benzoin resinoid - fixer
 benzyl cinnamate - fixer
 benzyl isoeugenol - fixer
 benzyl salicylate
isobornyl acetate
 caraway seed oil
 carrot seed oil
 cassia bark oil
 cedarwood oils
 cinnamyl alcohol - fixer
 cistus oil
 clary sage oil
 coriander seed oil
 costus valerolactone
 cyclamen aldehyde
 decanal
 dimethyl anthranilate
 dimethyl benzyl carbinol
 dodecanol
 ethyl cinnamate
 ethyl laurate
isoeugenyl acetate
 fir balsam absolute
 floral pyranol
 frankincense oil
 guaiacwood oil
 heliotropyl acetone
 juniper berry oil
 labdanum resinoid
 lavender absolute
laevo-linalool
 methyl cedryl ketone
 methyl ionones
 nerolidol
gamma-nonalactone
 nonanal
 nonanol
 ocean propanal
 patchouli ethanone
 raspberry ketone methyl ether
 rose butanoate
 santall
 spruce oil
 tolu balsam - fixer
 tonka bean absolute
 tuberose absolute
 verymoss
 watermelon ketone
 woody acetate
(odor and/or flavor) used in :
 amber
 balsam
 blackberry
 cassie acacia farnesiana
 citrus
 coconut
 cucumber
 dairy
 fat
 floral
 ginger
 herbal
 honey miel
 hops houblon
 incense
 kumquat
 moss
 muguet lily of the valley
 musk
 nut peanut
 orris iris
 violet
 waxy
 woody
natural occurrence in :
data pageangelica seed oil CO2 extract @ 0.40%
data pagebergamot oil @ 0.000-0.010%
blackberry
data pageblood orange oil (citrus sinensis l. var. sanguinello) italy @ 0.004%
data pageblood orange oil (citrus sinensis l. var. tarocco) italy @ 0.002%
data pageblood orange oil italy @ 0.003%
data pagecistus oil @ 0.1%
data pagecochlospermum planchonii oil @ 2.00%
data pagecoriander leaf oil @ 1.69-2.22%
data pagecoriander seed oil cuba @ 0.18%
cucumber
ginger
data pageglycosmis pentaphylla (cor.) bark oil india @ 0.20%
data pageherniaria incana lam. oil greece @ 0.30%
hop oil
kumquat peel
data pagelime oil distilled mexico @ 0.02%
data pagelime oil distilled peru @ 0.04%
data pagelime oil expressed florida @ trace%
data pagemandarin oil uruguay @ trace-0.01%
ocotea usambarensis
data pageorange peel oil sweet c.p. blond italy @ 0.003%
data pageorange peel oil sweet c.p. blond italy @ 0.003%
data pageorange peel oil sweet c.p. blond italy @ 0.003%
data pageorange peel oil sweet c.p. blond italy @ 0.005%
data pageorange peel oil sweet c.p. blond italy @ trace%
peanut
pinus sabiniana dougl.
data pagewitch hazel leaf oil @ 0.05%
data pageylang ylang oil CO2 extract @ 0.01%



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