ar-curcumene
organoleptics  properties  safety  references    FEMA Index    Home Page
 
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IUPAC name :1-methyl-4-[(2R)-6-methylhept-5-en-2-yl]benzene
InChI :InChI=1/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3/t14-/m1/s1
InChIKey :VMYXUZSZMNBRCN-CQSZACIVBI
SMILES :CC1=CC=C(C=C1)[C@H](C)CCC=C(C)C
cas number :4176-17-4
molar refractivity :68.32 ± 0.3 cm3
parachor :542.2 ± 4.0 cm3
index of refraction :1.501 ± 0.02
surface tension :29.9 ± 3.0 dyne/cm
density :0.873 ± 0.06 g/cm3
polarizability :27.08 ± 0.5 10-24cm3
XlogP : 5.80
XlogP3-AA : 5.40
molecular weight : 202.3351800 (IUPAC)
formula :C15 H22
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified
organoleptics :
properties :
assay : 90.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.87640 @ 0.00 °C.
refractive index :1.49400 @ 0.00 °C.
boiling point : 275.00 to 277.00 °C. @ 760.00 mm Hg
flash point : 243.00  °F.  TCC  ( 117.22 °C. )
logP (o/w) : 6.22
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-methyl-4-[(2R)-6-methylhept-5-en-2-yl]benzene
chemidplus :004176174
EPA Substance Registry Services :4176-17-4
references :
 
1-methyl-4-[(2R)-6-methylhept-5-en-2-yl]benzene
NIST Chemistry WebBook :4176174
pubchem :3885422
other :
VCF-Online: VCF Volatile Compounds in Food
synonyms :
laevo-alpha-curcumene
(R)-1-(1,5-dimethyl-4-hexenyl)-4-methyl benzene
1-methyl-4-[(2R)-6-methylhept-5-en-2-yl]benzene
soluble in :
 alcohol
insoluble in :
 water
natural occurrence in :
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data pageartemisia variabilis flower oil italy @ trace% S
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data pageginger root oil CO2 extract @ 10.87% S
data pageginger root oil CO2 extract australia @ 3.25% S
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data pagelemongrass oil morocco @ 0.10% S
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data pagepetitgrain combava oil @ trace%  
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data pageyarrow oil greece @ trace% S
data pageyuzu peel oil c.p. @ trace% S
data pageyuzu peel oil CO2 extract @ trace% S



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