heptyl propionate
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Notes :
Rose shader.
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :heptyl propanoate
InChI :InChI=1/C10H20O2/c1-3-5-6-7-8-9-12-10(11)4-2/h3-9H2,1-2H3
InChIKey :BGYICJVBGZQOCY-UHFFFAOYAK
SMILES :CCCCCCCOC(=O)CC
cas number :2216-81-1
(EINECS) number :218-698-2
molar refractivity :50.15 ± 0.3 cm3
parachor :454.7 ± 4.0 cm3
index of refraction :1.422 ± 0.02
surface tension :28.3 ± 3.0 dyne/cm
density :0.874 ± 0.06 g/cm3
polarizability :19.88 ± 0.5 10-24cm3
XlogP : 3.60
molecular weight : 172.2646000 (IUPAC)
formula :C10 H20 O2
NMR Predictor :Predict
 
 
export tariff code :2915.50.3000
fda reg :unspecified

Suppliers :
Vigon :Heptyl Propionate
Odor:  ETHEREAL-WINEY, BITTER

organoleptics :
odor type :floral
odor strength :medium
odor description :
at 100.00 %.  
rose apricot

properties :
appearence :colorless clear liquid
assay : 95.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.88500 @ 20.00 °C.
boiling point : 209.00 to 210.00 °C. @ 760.00 mm Hg
boiling point : 210.00 °C. @ 760.00 mm Hg
flash point : 175.00  °F.  TCC  ( 79.44 °C. )
logP (o/w) : 3.81

safety :
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 

safety in use :
 
recommendation for heptyl propionate usage levels up to :
  6.0000 % in the fragrance concentrate.

safety references :
EPI System :view
 
 
 
 heptyl propanoate
(EINECS) number :218-698-2
chemidplus :002216811
EPA Substance Registry Services :2216-81-1

references :
 heptyl propanoate
NIST Chemistry WebBook :3926859542
pubchem :159897

other :
synonyms :
 heptyl propanoate
 propanoic acid heptyl ester

soluble in :
 alcohol

insoluble in :
 water

(odor and/or flavor) blends with :
 allyl cyclohexyl valerate
 allyl propionate
isoamyl butyrate
 amyl isobutyrate
isoamyl isobutyrate
isoamyl nonanoate
 amyl propionate
isoamyl undecylenate
 apricot isobutyrate
 benzyl alcohol
 benzyl butyrate
 benzyl heptanoate
 benzyl hexanoate
 butyl benzyl ether
isobutyl decanoate
 butyl decylenate
 butyl nonanoate
 citronellol
 citronellyl formate
 citronellyl propionate
(E)-alpha-damascone
(Z)-alpha-damascone
gamma-damascone
isodecanal
(Z)-4-decen-1-yl acetate
 decen-1-yl cyclopentanone
 decyl butyrate
 dihydroactinidolide
 dihydrocarvyl acetate
alpha,alpha-dimethyl benzyl isobutyrate
2,6-dimethyl octanal
 dimethyl octanol
 ethyl octanoate
 farnesyl acetate
 floral pyran
 fruity cyclopentanone
2-furyl pentyl ketone
 geranyl acetate
(E)-geranyl acetone
 geranyl isobutyrate
(E)-geranyl linalool
 globulol
 hawthorn ethanol
 heptyl acetate
 heptyl isobutyrate
2-heptyl tetrahydrofuran
 jasmin lactone
 linalyl isovalerate
 linalyl valerate
2-methyl octanal
 musk acetate
 neryl acetate
 neryl isovalerate
 nonanal diethyl acetal
 nonanol
 peach cyclopentanone
 phenethyl acetate
 phenethyl anthranilate
 phenethyl heptanoate
 phenethyl isovalerate
 phenethyl phenyl acetate
 phenethyl salicylate
 phenyl acetaldehyde
 phenyl acetaldehyde digeranyl acetal
1-phenyl propyl butyrate
2-phenyl propyl butyrate
3-phenyl propyl cinnamate
 propyl butyrate
 propyl phenyl acetate
 rose butanoate
laevo-rose oxide
 strawberry glycidate 2
 styralyl propionate
 tetrahydrofurfuryl butyrate
 tmh aldehyde
gamma-undecalactone
 undecanol
10-undecen-1-al
(E)-2-undecen-1-ol
2-undecen-1-ol
(E)-2-undecen-1-yl acetate
 waxy acetate

(odor and/or flavor) used in :
 apricot
 peach
 pineapple
 rose
 waxy

natural occurrence in :
not found in nature



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