heptadecane
 
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IUPAC name :heptadecane
InChI :InChI=1/C17H36/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-17H2,1-2H3
InChIKey :NDJKXXJCMXVBJW-UHFFFAOYAV
SMILES :CCCCCCCCCCCCCCCCC
(EINECS) number :211-108-4
cas number :629-78-7
beilstein number :1738898
fl. number :01.075
molar refractivity :80.80 ± 0.3 cm3
parachor :708.4 ± 4.0 cm3
index of refraction :1.435 ± 0.02
surface tension :27.5 ± 3.0 dyne/cm
density :0.777 ± 0.06 g/cm3
polarizability :32.03 ± 0.5 10-24cm3
xlogp : 8.10
molecular weight : 240.4677400
formula :C17 H36
BioActivity Analysis :444266
 
 
export tariff code :2901.10.5000
fda reg :unspecified
 

organoleptics :

properties :
assay : 97.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.77700 @ 25.00 °C.
refractive index :1.43600 @ 20.00 °C.
melting point : 20.00 to 22.00 °C. @ 760.00 mm Hg
boiling point : 299.00 to 302.00 °C. @ 760.00 mm Hg
logp : 8.69

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
flash point ( Deg. F. ) : 300.00  °F.  TCC  ( 148.89 °C. )

safety references :
EPI System :view
 
 
 heptadecane
(EINECS) number :211-108-4
RTECS :MI3550000 for 629-78-7
chemidplus :000629787
EPA Substance Registry Services :629-78-7
NLM Chemical Carcinogenesis Research Information System :629-78-7
NLM Developmental and Reproductive Toxicity :629-78-7
NLM Env. Mutagen Info. Center :629-78-7
NLM GENetic TOXicology :629-78-7

references :
 heptadecane
fl. number :01.075
pubchem :155719
NIST Chemistry WebBook :2783794665

other :
synonyms :
 heptadecane
N-heptadecane

soluble in :
 alcohol

insoluble in :
 water

natural occurrence in :
data pageboronia absolute @ 0.70%
data pagecarnation absolute @ 0.02%
data pagecarrot leaf oil @ 0.40%
data pagecassie absolute @ 0.51%
data pagedialium guineense wild.fruit oil france @ 7.00%
data pageherniaria incana lam. oil greece @ 0.40%
data pageketaki flower oil india @ 0.30%
data pagemarjoram pot oil turkey @ 0.00-0.18%
data pagenarcissus absolute @ 0.01%
data pagerose oil otto bulgaria @ 0.19%
data pagethyme oil red CO2 extract @ 0.27%
data pagewitch hazel leaf oil @ 0.31%



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