rhodinyl isovalerate
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :3,7-dimethyloct-7-enyl 3-methylbutanoate
InChI :InChI=1/C15H28O2/c1-12(2)7-6-8-14(5)9-10-17-15(16)11-13(3)4/h13-14H,1,6-11H2,2-5H3
InChIKey :OZAWINZSOFVOBJ-UHFFFAOYAU
SMILES :CC(C)CC(=O)OCCC(C)CCCC(=C)C
(EINECS) number :231-919-7
cas number :7778-96-3
fema number :2987
coe number :460
jecfa number :77
fl. number :09.465
molar refractivity :72.80 ± 0.3 cm3
parachor :633.6 ± 4.0 cm3
index of refraction :1.441 ± 0.02
surface tension :28.0 ± 3.0 dyne/cm
density :0.873 ± 0.06 g/cm3
polarizability :28.86 ± 0.5 10-24cm3
xlogp : 5.40
molecular weight : 240.3816200
formula :C15 H28 O2
 
 
fda reg :172.515 h. number :2915.60.0000
organoleptics : 
odor type :floral
odor strength :medium
odor description :
at 100.00 %.  
sensual red rose
properties : 
appearence :colorless clear liquid
assay : 94.00 - 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 270.00 °C. @ 760.00 mm Hg
boiling point : 147.00 °C. @ 14.00 mm Hg
logp : 5.70
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
Maximised Survey-derived Daily Intakes (MSDI) :0.012 (μg/capita/day)
  
flash point ( Deg. F. ) : 194.00  °F.  TCC  ( 90.00 °C. )
  
recommendation for rhodinyl isovalerate usage levels up to :
  5.0000 % in the fragrance concentrate.
  
recommendation for rhodinyl isovalerate usage levels up to :
  10.0000 ppm in the flavor.
  
safety links : 
(EINECS) number :231-919-7
chemidplus :007778963
epa-srs :7778-96-3
  
other : 
 
references : 
jecfa number :77
fl. number :09.465
pubchem :204200
  
synonyms :
(S)-3,7-dimethyl oct-7-enyl 3-methyl butanoate
(S)-3,7-dimethyl oct-7-enyl isovalerate
3,7-dimethyl-6 or 7-octen-1-yl 3-methyl butanoate
3,7-dimethyl-6 or 7-octen-1-yl isopentanoate
3,7-dimethyl-6 or 7-octen-1-yl isovalerate
 rhodinyl 3-methyl butanoate
 rhodinyl isopentanoate
 rhodinyl isovalerate
 rhodinyl isovalerianate
soluble in :
 alcohol
 water, very slightly
insoluble in :
 water
(odor and/or flavor) blends with :
isoamyl undecylenate
para-anisyl alcohol
 benzophenone
 benzyl alcohol
 benzyl isobutyrate
 butyl angelate
 butyl benzyl ether
 cassis buteneone
 citronellal
 citronellal diisotridecyl acetal
laevo-citronellol
 citronellyl acetate
laevo-citronellyl acetate
 citronellyl anthranilate
 citronellyl cinnamate
 citronellyl hexanoate
 citronellyl isobutyrate
 citronellyl propionate
(E)-citronellyl tiglate
 cyclohexyl propanol
beta-damascenone
(E)-alpha-damascone
(Z)-alpha-damascone
delta-damascone
gamma-damascone
(E,Z)-2,4-decadien-1-al
isodecanal
(Z)-4-decen-1-yl acetate
 dibutyl sulfide
 dihydrocarvyl acetate
 dihydrorose oxide
 dimethyl benzyl carbinyl acetate
 dimethyl octanyl acetate
 diphenyl methane
 diphenyl oxide
(E)-ethyl geranate
 ethyl linalyl acetate
 ethyl nonanoate
 ethyl ortho-anisate
(E)-ethyl tiglate
 farnesyl acetate
 floral pyran
 geraniol
 geranium cyclohexane
 geranium dihydropyran
 geranium nitrile
 geranium oil africa
 geranium oil egypt
 geranium pyran
 geranium thiazole
 geranyl acetate
 geranyl butyrate
 geranyl formate
 geranyl hexanoate
 geranyl isobutyrate
(E)-geranyl linalool
 geranyl nonanoate
 geranyl octanoate
 geranyl propionate
 geranyl tiglate
 geranyl valerate
 globulol
 hawthorn ethanol
2-heptyl tetrahydrofuran
(Z)-3-hexen-1-yl phenyl acetate
 hexyl phenyl acetate
 leather cyclohexanol
 linalyl formate
 methyl 10-undecenal
 methyl citronellate
2-methyl octanal
 musk acetate
 narcissus acetate
 neryl acetate
 neryl isovalerate
 nonanal diethyl acetal
 nonanol
 octyl formate
 peony acetonitrile
 phenethyl acetate
 phenethyl anthranilate
 phenethyl formate
 phenethyl isobutyrate
 phenethyl isovalerate
 phenethyl phenyl acetate
 phenethyl pivalate
 phenethyl propionate
 phenethyl salicylate
 phenethyl valerate
 phenyl acetaldehyde
 phenyl acetaldehyde digeranyl acetal
 phenyl acetic acid
 phenyl propyl phenyl acetate
 rhodinyl acetate
 rhodinyl butyrate
 rhodinyl isobutyrate
 rhodinyl propionate
 rose acetate
 rose carbonate
(Z)-rose oxide
laevo-rose oxide
 rose pyran
 santalyl butyrate
 strawberry glycidate 2
 styralyl propionate
(E)-2-undecen-1-ol
2-undecen-1-ol
(odor and/or flavor) used in :
 almond
 apricot
 cherry
 peach
 plum
natural occurrence in :
not found in nature



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