verbenol
 
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IUPAC name :4,7,7-trimethylbicyclo[3.1.1]hept-3-en-2-ol
InChI :InChI=1/C10H16O/c1-6-4-9(11)8-5-7(6)10(8,2)3/h4,7-9,11H,5H2,1-3H3
InChIKey :WONIGEXYPVIKFS-UHFFFAOYAI
SMILES :CC1=CC(C2CC1C2(C)C)O
(EINECS) number :207-470-8
cas number :473-67-6
fema number :3594
coe number :10304
jecfa number :1404
fl. number :02.101
molar refractivity :45.55 ± 0.3 cm3
parachor :362.5 ± 6.0 cm3
index of refraction :1.511 ± 0.02
surface tension :32.4 ± 3.0 dyne/cm
density :1.002 ± 0.06 g/cm3
polarizability :18.05 ± 0.5 10-24cm3
xlogp : 2.10
molecular weight : 152.2334400
formula :C10 H16 O
BioActivity Analysis :98376
 
 
export tariff code :2906.19.5000
fda reg :unspecified
 

Suppliers :
Bedoukian Research :VERBENOL
 ≥94.0%, Kosher
 
 

organoleptics :
odor type :balsamic
odor strength :medium
odor description :
at 100.00 %.  
fresh pine ozone

properties :
appearence :white to pale yellow crystalline solid
assay : 94.00 - 100.00 %   
Food Chemicals Codex Listed :No
refractive index :1.49000 @ 20.00 °C.
melting point : 52.00 - 63.00 °C. @ 760.00 mm Hg
boiling point : 214.00 - 215.00 °C. @ 760.00 mm Hg
acid value : 1.00  max.  KOH/g
logp : 2.46

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 185.00  °F.  TCC  ( 85.00 °C. )
  
recommendation for verbenol usage levels up to :
  3.0000 % in the fragrance concentrate.
  
recommendation for verbenol usage levels up to :
  10.0000 ppm in the flavor.
  

safety links :
(EINECS) number :207-470-8
chemidplus :000473676
epa-srs :473-67-6
dtp/nci :44159
  

other :
 

references :
jecfa number :1404
fl. number :02.101
pubchem :197377
NIST Chemistry WebBook :4244411735
  
synonyms :
 berbenol
4-hydroxy-2,6,6-trimethyl bicyclo(3.1.1)hept-2-ene
2-pinen-4-ol
4,6,6-trimethyl bicyclo(3.1.1)hept-3-en-2-ol
 verbenol
dextro-verbenol
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) used in :
 herbal
 incense
 lavender spike lavender
 ozone
 pine
 rosemary
natural occurrence in :
data pagebay leaf oil anise @ 0.4%
data pagebay leaf oil clove @ 1.2%
data pagecarrot seed oil @ 2.34%
olibanum resin
turpentine oil



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