cadalene
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IUPAC name :1,6-dimethyl-4-propan-2-ylnaphthalene
InChI :InChI=1/C15H18/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5-10H,1-4H3
InChIKey :VMOJIHDTVZTGDO-UHFFFAOYAQ
SMILES :CC1=CC2=C(C=CC(=C2C=C1)C)C(C)C
cas number :483-78-3
molar refractivity :67.93 ± 0.3 cm3
parachor :501.4 ± 4.0 cm3
index of refraction :1.572 ± 0.02
surface tension :34.9 ± 3.0 dyne/cm
density :0.961 ± 0.06 g/cm3
polarizability :26.92 ± 0.5 10-24cm3
XlogP : 5.60
XlogP3 : 5.60
molecular weight : 198.3034200 (IUPAC)
formula :C15 H18
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified

organoleptics :

properties :
assay : 97.00 to 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 294.00 to 298.00 °C. @ 760.00 mm Hg
flash point : 284.00  °F.  TCC  ( 140.00 °C. )
logP (o/w) : 5.72

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

safety in use :
 

safety references :
EPI System :view
 
 
 
 1,6-dimethyl-4-propan-2-ylnaphthalene
chemidplus :000483783
EPA Substance Registry Services :483-78-3

references :
 1,6-dimethyl-4-propan-2-ylnaphthalene
NIST Chemistry WebBook :366346279
pubchem :153474

other :
VCF-Online: VCF Volatile Compounds in Food
synonyms :
1,6-dimethyl-4-(1-methyl ethyl) naphthalene
1,6-dimethyl-4-propan-2-ylnaphthalene
4-isopropyl-1,6-dimethyl naphthalene

soluble in :
 alcohol

insoluble in :
 water

natural occurrence in :
data pageayou wood oil @ 0.60%
data pagecallitris columellaris wood oil australia @ 0.80%
data pagecallitris glaucophylla wood oil australia @ 3.30%
data pagecallitris intratropica wood oil australia @ 2.30%
data pagecascarilla bark oil @ 0.22%
data pagecistus oil @ 0.5%
data pagegeranium rose-scented oil (pelargonium spp.) cuba @ 1.00%
data pagelaurel leaf oil turkey @ 0.10%
data pagelavender oil france @ trace%
data pagewitch hazel leaf oil @ 0.05%



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