benzyl pivalate
propanoic acid, 2,2-dimethyl-, phenylmethyl ester
 
Notes:
None found
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Fragrance Demo Formulas
CAS Number: 2094-69-1Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 218-251-1
FDA UNII: Search
Nikkaji Web: J117.445B
XlogP3: 3.40 (est)
Molecular Weight: 192.25792000
Formula: C12 H16 O2
BioActivity Summary: listing
NMR Predictor: Predict (works with chrome, Edge or firefox)
Category: flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 248.00 to  249.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 0.024000 mmHg @ 25.00 °C. (est)
Flash Point: 203.00 °F. TCC ( 94.90 °C. ) (est)
logP (o/w): 3.272 (est)
Soluble in:
 water, 54.93 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor Type: floral
 
 floral  herbal  chamomile  
Odor Description:
at 100.00 %. 
floral herbal chamomile
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
Ernesto Ventós
BENZYL PIVALATE
Odor: CHAMOMILLE, FLORAL, SWEET
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Safety Information:
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: flavor and fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
 
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 2094-69-1
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 74977
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 2
 benzyl 2,2-dimethylpropanoate
Chemidplus: 0002094691
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References:
 benzyl 2,2-dimethylpropanoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 2094-69-1
Pubchem (cid): 74977
Pubchem (sid): 135032585
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Other Information:
(IUPAC): Atomic Weights of the Elements 2011 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
HMDB (The Human Metabolome Database): Search
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
balsamic
 benzyl benzoateFL/FR
 benzyl salicylateFL/FR
 cyclohexyl benzoateFL/FR
 santolina oil 
burnt
 lepidineFL/FR
citrus
 acetaldehyde citronellyl methyl acetalFR
 jambu flower oil brazil 
floral
ortho-acetyl-para-cresolFL/FR
isoamyl angelateFL/FR
isoamyl salicylateFL/FR
 amyl salicylateFL/FR
 butyl tiglateFR
 cassie absolute replacerFL/FR
 cassis cyclohexeneFR
 citronellalFL/FR
 citronellyl isovalerateFL/FR
 cymbopogon validus leaf oilFR
 dihydromyrceneFR
2,4-dimethyl-3-cyclohexene-1-methanolFR
 eau de brouts absoluteFR
 heather fragranceFR
 heliotrope absoluteFR
 herbal pyranFR
 hexyl oxyacetonitrile 
 ho leaf oilFR
 ilex paraguariensis oleoresinFL/FR
beta-ionolFL/FR
(Z)-jasmoneFL/FR
isojasmoneFL/FR
 karo karounde absoluteFR
 lavandin concrete decolorizedFR
 lavandin oilFL/FR
 lavandula angustifolia flower oilFL/FR
 lavender absolute replacerFR
 lavender oilFL/FR
 lavender oil bulgariaFL/FR
 lavender oil franceFL/FR
 lavender oil greeceFL/FR
 lavender oil replacerFR
 methyl nerate 
 nonisyl propionateFR
(Z)-beta-ocimeneFL/FR
 pelargonium graveolens flower waterFR
isophytolFL/FR
 prenyl salicylateFL/FR
 sambucus nigra flower oil CO2 extractFR
 terpinyl isobutyrateFL/FR
 tetrahydrolinalyl acetateFR
fruity
 allyl phenoxyacetateFL/FR
 eriocephalus punctulatus flower oilFR
 heptyl butyrateFL/FR
 sambucus canadensis fruit absoluteFL/FR
green
 acetaldehyde di-(Z)-3-hexen-1-yl acetalFL/FR
 acetaldehyde ethyl phenethyl acetalFL/FR
isobutyl benzyl carbinolFL/FR
 heptyl formateFL/FR
(Z)-3-hexen-1-yl angelateFR
 marigold pot absoluteFL/FR
herbal
 anthemis nobilis flower extractFL/FR
 anthemis nobilis flower oil englandFL/FR
 anthemis nobilis flower oil romanFL/FR
 anthemis nobilis flower waterFR
 anthemis nobilis oilFL/FR
 arnica flower absoluteFR
 butyl 3-pentenoate 
 calendula officinalis flower oil CO2 extractFR
 cananga fruit oilFR
 carrot seed oil (daucus carota ssp. gummifer hook. fil.) spainFR
 chamomile absoluteFL/FR
 chamomile concreteFR
 chamomile distillatesFL/FR
 chamomile extractFL/FR
 chamomile fragranceFR
 chamomile isobutyrateFR
 chamomile octenoneFR
 chamomile oil moroccoFR
 chamomile oil replacerFR
 chamomile propionateFR
 chamomile specialtyFR
 chamomile valerateFR
 chrysanthemum ketoneFR
 coriander seed absoluteFL/FR
 herbal acetalFR
 inula root oilFR
 lavandin flower waterFR
 lavender absolute bulgariaFL/FR
 lavender oil terpenelessFL/FR
 lavender stem oil lithuaniaFR
 levisticum officinale root absoluteFL/FR
 marigold pot flower oilFL/FR
 matricaria chamomilla flower oilFL/FR
laevo-menthyl propionateFL/FR
 methyl cyclogeranate (Firmenich)FR
 methyl ortho-anisateFL/FR
 myrtle oil moroccoFL/FR
 nonisyl acetateFR
 ormenis multicaulis flower oil moroccoFR
 tagete oil egyptFL/FR
2,4,6-trimethyl-6-(3-methyl-2-buten-1-yl)-2-cyclohexen-1-one 
spicy
 carnation absoluteFR
 levisticum officinale root oilFL/FR
woody
 cistus twig/leaf oilFL/FR
3-methyl pentyl angelateFR
 zdravetz absoluteFR
 zdravetz oilFL/FR
 
For Flavor
 
No flavor group found for these
 acetaldehyde di-(Z)-3-hexen-1-yl acetalFL/FR
ortho-acetyl-para-cresolFL/FR
isoamyl angelateFL/FR
 butyl 3-pentenoate 
 cassie absolute replacerFL/FR
 citronellyl isovalerateFL/FR
 cyclohexyl benzoateFL/FR
 hexyl oxyacetonitrile 
 ilex paraguariensis oleoresinFL/FR
 jambu flower oil brazil 
 marigold pot flower oilFL/FR
laevo-menthyl propionateFL/FR
 methyl nerate 
 methyl ortho-anisateFL/FR
 myrtle oil moroccoFL/FR
 santolina oil 
 terpinyl isobutyrateFL/FR
2,4,6-trimethyl-6-(3-methyl-2-buten-1-yl)-2-cyclohexen-1-one 
(E)-4-undecenalFL
 zdravetz oilFL/FR
amber
isobutyl benzyl carbinolFL/FR
aromatic
 amyl salicylateFL/FR
balsamic
 benzyl benzoateFL/FR
 benzyl salicylateFL/FR
fatty
 heptyl formateFL/FR
floral
 citronellalFL/FR
beta-ionolFL/FR
 lepidineFL/FR
fruity
 allyl phenoxyacetateFL/FR
 sambucus canadensis fruit absoluteFL/FR
green
 acetaldehyde ethyl phenethyl acetalFL/FR
isoamyl salicylateFL/FR
 heptyl butyrateFL/FR
isojasmoneFL/FR
 marigold pot absoluteFL/FR
(Z)-beta-ocimeneFL/FR
herbal
 anthemis nobilis flower extractFL/FR
 anthemis nobilis flower oil englandFL/FR
 anthemis nobilis flower oil romanFL/FR
 anthemis nobilis oilFL/FR
 chamomile absoluteFL/FR
 chamomile distillatesFL/FR
 chamomile extractFL/FR
 coriander seed absoluteFL/FR
 lavandin oilFL/FR
 lavandula angustifolia flower oilFL/FR
 lavender absolute bulgariaFL/FR
 lavender oilFL/FR
 lavender oil bulgariaFL/FR
 lavender oil franceFL/FR
 lavender oil greeceFL/FR
 lavender oil terpenelessFL/FR
 matricaria chamomilla flower oilFL/FR
 prenyl salicylateFL/FR
 tagete oil egyptFL/FR
oily
isophytolFL/FR
 levisticum officinale root absoluteFL/FR
 levisticum officinale root oilFL/FR
woody
 cistus twig/leaf oilFL/FR
(Z)-jasmoneFL/FR
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 benzyl 2,2-dimethylpropanoate
 benzyl 2,2-dimethylpropionate
2,2-dimethyl propanoic acid phenyl methyl ester
 pivalic acid benzyl ester
 pivalic acid, benzyl ester
 propanoic acid, 2,2-dimethyl-, phenylmethyl ester
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