sabinyl acetate
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :(4-methylidene-1-propan-2-yl-3-bicyclo[3.1.0]hexanyl) acetate
InChI :InChI=1/C12H18O2/c1-7(2)12-5-10(12)8(3)11(6-12)14-9(4)13/h7,10-11H,3,5-6H2,1-2,4H3
InChIKey :PBWRFXQNNGSAQG-UHFFFAOYAW
SMILES :CC(C)C12CC1C(=C)C(C2)OC(=O)C
cas number :3536-54-7
molar refractivity :54.85 ± 0.4 cm3
parachor :452.7 ± 6.0 cm3
index of refraction :1.488 ± 0.03
surface tension :32.1 ± 5.0 dyne/cm
density :1.02 ± 0.1 g/cm3
polarizability :21.74 ± 0.5 10-24cm3
xlogp : 2.99
molecular weight : 194.2701200
formula :C12 H18 O2
 
 
export tariff code :unspecified
fda reg :unspecified
 

organoleptics :

properties :
appearence :colorless clear liquid
assay : 92.00 to 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 230.00 to 231.00 °C. @ 760.00 mm Hg
logp : 3.13

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
flash point ( Deg. F. ) : 183.00  °F.  TCC  ( 83.89 °C. )

safety references :
EPI System :view
 
 
 (4-methylidene-1-propan-2-yl-3-bicyclo[3.1.0]hexanyl) acetate
chemidplus :003536547
EPA Substance Registry Services :3536-54-7
NLM Chemical Carcinogenesis Research Information System :3536-54-7
NLM Developmental and Reproductive Toxicity :3536-54-7
NLM Env. Mutagen Info. Center :3536-54-7
NLM GENetic TOXicology :3536-54-7

references :
 (4-methylidene-1-propan-2-yl-3-bicyclo[3.1.0]hexanyl) acetate
pubchem :671336
NIST Chemistry WebBook :3647925089

other :
synonyms :
4-methylene-1-(1-methyl ethyl) bicyclo(3.1.0)hexan-3-ol acetate
4-methylene-1-(1-methyl ethyl) bicyclo(3.1.0)hexan-3-yl acetate
(4-methylidene-1-propan-2-yl-3-bicyclo(3.1.0)hexyl) acetate
 sabinene hydrate acetate
 sabinyl acetate
4(10)-thujen-3-ol acetate

soluble in :
 alcohol

insoluble in :
 water

natural occurrence in :
data pageangelica root oil @ 0.15%
data pageboldo leaf oil italy @ 4.28%
data pageboldus leaf oil chile @ 2.36%
data pagehyssop oil @ 0.3%
data pagelaurel leaf oil turkey @ 0.10%
data pagelime oil distilled mexico @ 0.01%
data pagerosemary oil egypt @ 0.11%
data pagesage oil spain @ 0.30%
data pagevalerian root oil CO2 extract china @ 3.03%
data pagewormwood oil italy @ 1.6%
data pagewormwood oil poland @ 20.13%



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