peach pivalate
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InChI :InChI=1/C15H22O2/c1-15(2,3)14(16)17-13-8-9-7-12(13)11-6-4-5-10(9)11/h4-5,9-13H,6-8H2,1-3H3
InChIKey :MEAGMJILPLJCFQ-UHFFFAOYAR
SMILES :CC(C)(C)C(=O)OC1CC2CC1C3C2C=CC3
cas number :68039-44-1
(EINECS) number :268-259-4
molar refractivity :67.03 ± 0.4 cm3
parachor :541.5 ± 6.0 cm3
index of refraction :1.522 ± 0.03
surface tension :36.8 ± 5.0 dyne/cm
density :1.06 ± 0.1 g/cm3
polarizability :26.57 ± 0.5 10-24cm3
XlogP : 3.40
molecular weight : 234.3339800 (IUPAC)
formula :C15 H22 O2
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified
Suppliers :
Givaudan :Pivacyclene
Odor:  Fruity, Peach, Green
Pivacyclene has a dry fruity peach note with a fresh green softness. It works well with the other cyclenes as a modifier around 1% in soaps and detergents. Also ideal for cosmetics and toiletries at 5% or above if fragrance character allows. It is often used in combination with gamma-lactones to soften the fatty aspects.
Vigon :PIVACYCLENE
organoleptics :
odor strength :medium
odor description:
at 100.00 %.  		fruity peach sweet powdery green floral
properties :
appearence :colorless to pale yellow clear liquid
assay : 98.00 to 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 299.00 to 300.00 °C. @ 760.00 mm Hg
flash point : 260.00  °F.  TCC  ( 126.67 °C. )
logP (o/w) : 3.93
safety :
Oral Toxicity(LD50) : 
  Not determined
Dermal Toxicity(LD50) : 
  Not determined
Inhalation Toxicity(LC50) : 
  Not determined
 
safety in use :
Category :fragrance agents
 
recommendation for peach pivalate fragrance usage levels up to :
  8.0000 % in the fragrance concentrate.
recommendation for peach pivalate flavor usage levels up to :
 not for flavor use.
safety references :
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
 
 
(EINECS) number :268-259-4
chemidplus :068039441
EPA Substance Registry Services :68039-44-1
references :
pubchem :684272
Cosmetics :
Cosmetic uses : perfuming agents
other :
CosIng :cosmetic data
synonyms :
3a,4,5,6,7,7a-hexahydro-4,7-methano-1H-inden-6-yl pivalate
 hexahydro-4,7-methanoinden-5(or 6)-yl pivalate
 hexahydromethanoinden-6-yl pivalate
 peach pivalate
 pivacyclene
 tricyclo(5.2.1.0~2,6~)dec-4-en-8-yl 2,2-dimethyl propanoate
soluble in :
 alcohol
insoluble in :
 water
potential blenders :    note
 acetaldehyde benzyl 2-methoxyethyl acetalFL/FR
 acetaldehyde dihexyl acetalFL/FR
 acetaldehyde methyl hexyl acetalFR
 allyl 2-ethyl butyrateFL
 allyl amyl glycolateFR
 allyl butyrateFL/FR
 allyl cinnamateFL/FR
 allyl cyclohexyl valerateFL
 allyl tiglateFL
isoamyl benzoateFL/FR
isoamyl butyrateFL/FR
alpha-amyl cinnamaldehyde diethyl acetalFR
isoamyl formateFL/FR
 amyl hexanoateFL/FR
isoamyl isovalerateFL/FR
isoamyl laurateFL/FR
isoamyl octanoateFL/FR
para-anisyl propionateFL/FR
 benzyl octanoateFL/FR
 berry pentadienoateFL/FR
 boronia absoluteFL/FR
 buchu mercaptanFL/FR
 butyl 2-methyl butyrateFL/FR
 butyl decylenateFL/FR
isobutyl hexanoateFL/FR
 butyl isobutyrateFL/FR
 butyl isovalerateFL/FR
isobutyl propionateFL/FR
 cherry pentenoateFL/FR
 cinnamyl alcoholFL/FR
 citronellyl formateFL/FR
 citronellyl propionateFL/FR
 cognac heptanoneFL/FR
 creamy lactoneFL/FR
para-cresyl isobutyrateFL/FR
beta-cyclocitralFL/FR
 cyclohexyl cinnamateFL/FR
2-cyclopentyl cyclopentanoneFL/FR
gamma-damasconeFR
alpha-decalactoneFR
delta-decalactoneFL/FR
gamma-decalactoneFL/FR
 decen-1-yl cyclopentanoneFL/FR
3-decen-2-oneFL/FR
9-decenoic acidFL/FR
delta-decenolactoneFL
 diethyl malonateFL/FR
alpha,alpha-dimethyl benzyl isobutyrateFL/FR
 dimethyl succinateFL/FR
6,8-dimethyl-2-nonanolFR
(E,E)-2,4-dodecadien-1-olFR
delta-dodecalactoneFL/FR
epsilon-dodecalactoneFL/FR
gamma-dodecalactoneFL/FR
 ethyl (E)-2-hexenoateFL/FR
 ethyl (E)-2-octenoateFL
 ethyl (E)-4-decenoateFL/FR
 ethyl 2-cyclohexyl propionateFR
 ethyl 2-octenoateFL/FR
 ethyl 3-acetoxyhexanoateFL/FR
 ethyl 3,5,5-trimethyl hexanoateFR
 ethyl acetoacetateFL/FR
 ethyl cyclohexane propionateFL/FR
 ethyl methyl-para-tolyl glycidateFL/FR
2-ethyl-4-butanolFL/FR
 fir carboxylateFR
 fruity butanateFR
 fruity cyclopentanoneFR
 furfuryl octanoateFL
 furfuryl propionateFL
2-furyl pentyl ketoneFL
(E)-geranyl acetoneFL/FR
 geranyl isobutyrateFL/FR
 geranyl isovalerateFL/FR
 glyceryl 5-hydroxydecanoateFL/FR
 glyceryl 5-hydroxydodecanoateFL/FR
 grapefruit menthaneFL/FR
 green dioxolaneFR
(E,E)-2,4-heptadien-1-olFL
 heptanal cyclic ethylene acetalFR
2-heptanolFL/FR
2-heptyl cyclopentanoneFR
 heptyl isobutyrateFL/FR
 hexanal propylene glycol acetalFL/FR
2-hexen-1-alFL
(E)-2-hexen-1-al diethyl acetalFL
2-hexen-1-al diethyl acetalFL
2-hexen-1-olFL/FR
(Z)-3-hexen-1-yl (E)-2-hexenoateFL/FR
(Z)-3-hexen-1-yl 2-methyl-2-pentenoateFR
(E)-2-hexen-1-yl acetateFL/FR
(E)-3-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl acetateFL/FR
2-hexen-1-yl acetateFL/FR
(E)-2-hexen-1-yl formateFL/FR
(E)-2-hexen-1-yl hexanoateFL/FR
(Z)-3-hexen-1-yl hexanoateFL/FR
(Z)-3-hexen-1-yl isobutyrateFL/FR
(Z)-3-hexen-1-yl isovalerateFL/FR
(E)-2-hexen-1-yl propionateFL/FR
(E)-2-hexen-1-yl valerateFL
(Z)-3-hexen-1-yl valerateFL/FR
1-hexen-3-yl acetate 
 hexyl (E)-2-hexenoateFL
 hexyl 2-butenoateFL/FR
 hexyl acetateFL/FR
 hexyl butyrateFL/FR
 hexyl isobutyrateFL/FR
 hexyl isovalerateFL/FR
 hexyl octanoateFL/FR
 hexyl pivalateFR
 hexyl propionateFL/FR
 jasmin lactoneFL/FR
 jasmin pyranoneFL/FR
 lily propanolFR
 linalyl hexanoateFL/FR
 linalyl isovalerateFL/FR
 marigold oil mexico 
 melon valerateFL/FR
 methyl (E)-2-hexenoateFL
 methyl (E)-3-nonenoateFL/FR
 methyl (E)-3-nonenoateFL
 methyl 2-hexenoateFL/FR
 methyl 2-undecynoateFL
 methyl 4-pentenoateFL
2-methyl butyl 2-methyl butyrateFL/FR
(E)-methyl geranateFL/FR
 methyl heptanoateFL/FR
 methyl R-3-acetoxyhexanoate 
2-methyl valeraldehydeFL
 methyl valerateFL/FR
3-methyl valeric acidFL
(E)-2-methyl-2-octen-1-alFL
2-methyl-2-octen-1-alFL
3-methyl-3-pentanolFL
 nerolidyl isobutyrateFR
(E,E)-3,5-octadien-2-oneFL
 octen-1-yl cyclopentanoneFL/FR
 octyl 2-methyl butyrateFL/FR
 octyl butyrateFL/FR
 papaya isobutyrateFL/FR
 peach cyclopentanoneFR
 peach nitrileFR
(E)-2-penten-1-alFL/FR
2-pentyl furanFL/FR
 phenethyl isobutyrateFL/FR
 phenethyl isovalerateFL/FR
 phenoxyethyl isobutyrateFL/FR
4-phenyl-2-butyl acetateFL/FR
 pineapple pentenoateFL/FR
 plum crotonateFR
 prenolFL/FR
 prenyl ethyl etherFL/FR
 prenyl hexanoateFL/FR
isopropyl 2-methyl butyrateFL/FR
alpha-isopropyl phenyl acetaldehydeFL/FR
 propylene acetalFL/FR
 rhubarb undecaneFR
 sorbyl isobutyrateFL/FR
 tagete oil indiaFL/FR
 tetrahydrofurfuryl butyrateFL/FR
 thiogeraniolFL/FR
 tiglaldehydeFL/FR
 timber dioxolaneFR
 tricyclodecyl acetateFR
 tropical indeneFR
 tropical thiazoleFL/FR
delta-undecalactoneFL/FR
gamma-undecalactoneFL/FR
isovaleraldehydeFL
 violet dienyneFR
 woody acetateFR
potential uses :
 apple green apple
 fig
 floral
 fruit
 guava
 hibiscus
 jasmin
 passion blossom
 peach
 peach blossom
natural occurrence in :    note
 not found in nature  

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