beta-maaliene
 
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IUPAC name :1,1,3a,7-tetramethyl-1a,2,3,3a,4,5,6,7b-octahydro-1H-cyclopropa[a]naphthalene
InChI :InChI=1/C15H24/c1-10-6-5-8-15(4)9-7-11-13(12(10)15)14(11,2)3/h11,13H,5-9H2,1-4H3
InChIKey :UPGLJTCDRBIZKP-UHFFFAOYAY
SMILES :CC1=C2C3C(C3(C)C)CCC2(CCC1)C
cas number :489-29-2
molar refractivity :64.79 ± 0.4 cm3
parachor :510.9 ± 6.0 cm3
index of refraction :1.515 ± 0.03
surface tension :32.0 ± 5.0 dyne/cm
density :0.95 ± 0.1 g/cm3
polarizability :25.68 ± 0.5 10-24cm3
xlogp : 4.20
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 : 257.00 to 258.00 °C. @ 760.00 mm Hg
logp : 6.43

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
flash point ( Deg. F. ) : 209.00  °F.  TCC  ( 98.33 °C. )

safety references :
EPI System :view
 
 
 1,1,3a,7-tetramethyl-1a,2,3,3a,4,5,6,7b-octahydro-1H-cyclopropa[a]naphthalene
chemidplus :489-29-2
EPA Substance Registry Services :489-29-2
NLM Chemical Carcinogenesis Research Information System :489-29-2
NLM Developmental and Reproductive Toxicity :489-29-2
NLM Env. Mutagen Info. Center :489-29-2
NLM GENetic TOXicology :489-29-2

references :
 1,1,3a,7-tetramethyl-1a,2,3,3a,4,5,6,7b-octahydro-1H-cyclopropa[a]naphthalene
pubchem :10523948
NIST Chemistry WebBook :3369047621

other :
synonyms :
beta-maaliene
beta-maalinene
1,1,3alpha,7-tetramethyl-1alpha,2,3,3alpha,4,5,6,7beta-octahydro-1H-cyclopropa(a)naphthalene

soluble in :
 alcohol

insoluble in :
 water

natural occurrence in :
data pagebombycilaena erecta oil greece @ 1.20%
data pagecascarilla bark oil @ 0.01%
data pageotanthus maritimus (l.) hoffmans oil greece @ trace%
data pagepatchouli oil china @ 0.66%
data pagetea tree oil australia @ trace%



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