longicyclene
 
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InChI :InChI=1/C15H24/c1-13(2)6-5-7-14(3)9-8-10-12(11(9)13)15(10,14)4/h9-12H,5-8H2,1-4H3
InChIKey :WCEIQUQVIOGRBF-UHFFFAOYAZ
SMILES :CC1(CCCC2(C3C1C4C2(C4C3)C)C)C
(EINECS) number :214-504-5
cas number :1137-12-8
molar refractivity :63.42 ± 0.3 cm3
parachor :514.5 ± 4.0 cm3
index of refraction :1.527 ± 0.02
surface tension :38.8 ± 3.0 dyne/cm
density :0.991 ± 0.06 g/cm3
polarizability :25.14 ± 0.5 10-24cm3
xlogp : 5.50
molecular weight : 204.3510600
formula :C15 H24
 
 
export tariff code :unspecified
fda reg :unspecified
 

organoleptics :

properties :
assay : 95.00 to 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 239.00 to 240.00 °C. @ 760.00 mm Hg
logp : 6.07

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
flash point ( Deg. F. ) : 193.00  °F.  TCC  ( 89.44 °C. )

safety references :
EPI System :view
 
 
(EINECS) number :214-504-5
chemidplus :1137-12-8
EPA Substance Registry Services :1137-12-8
NLM Chemical Carcinogenesis Research Information System :1137-12-8
NLM Developmental and Reproductive Toxicity :1137-12-8
NLM Env. Mutagen Info. Center :1137-12-8
NLM GENetic TOXicology :1137-12-8

references :
pubchem :10504425
NIST Chemistry WebBook :637217213

other :
synonyms :
(1S- (1alpha,2alpha,3abeta, 4alpha,8abeta,9R*))-decahydro-1,5,5,8a-tetramethyl-1,2,4-methenoazulene
 longicyclene

soluble in :
 alcohol

insoluble in :
 water

natural occurrence in :
data pageangelica root oil @ 0.07%
data pagecroton cajucara benth. leaf oil brazil @ 0.90%
data pagecroton flavens l. (welensali) leaf oil curacao @ 0.20%
data pagehinoki leaf oil @ 0.41%
data pagehinoki root oil @ 0.65%
data pagehinoki wood oil @ 0.05%



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