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benzaldehyde diethyl acetal
(diethoxymethyl)benzene

Supplier Sponsors

Name:diethoxymethylbenzene
CAS Number: 774-48-1Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:212-265-1
FDA UNII:236M0R125W
Nikkaji Web:J79.949A
MDL:MFCD00038525
CoE Number:517
XlogP3-AA:2.30 (est)
Molecular Weight:180.24692000
Formula:C11 H16 O2
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome or firefox)
Category:flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
FLAVIS Number:06.017 (Old)
DG SANTE Food Flavourings:06.017 (diethoxymethyl)benzene
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.90300 to 0.90900 @ 25.00 °C.
Pounds per Gallon - (est).: 7.514 to 7.564
Refractive Index:1.47500 to 1.48100 @ 20.00 °C.
Boiling Point: 222.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.241000 mm/Hg @ 25.00 °C. (est)
Flash Point: 148.00 °F. TCC ( 64.50 °C. ) (est)
logP (o/w): 2.652 (est)
Soluble in:
 alcohol
 water, 469.5 mg/L @ 25 °C (est)
Insoluble in:
 water
Stability:
 alkalis
Similar Items:note
acrolein diethyl acetal
alpha-amyl cinnamaldehyde diethyl acetal
para-anisaldehyde diethyl acetal
butyraldehyde diethyl acetal
isobutyraldehyde diethyl acetal
cinnamaldehyde diethyl acetal
citral diethyl acetal
citronellal diethyl acetal
citronellyl oxyacetaldehyde diethyl acetal
crotonaldehyde diethyl acetal
cyclamen aldehyde diethyl acetal
cyclohexanone diethyl acetal
decanal diethyl acetal
(Z)-4-decen-1-al diethyl acetal
dodecanal diethyl acetal
3-ethoxypropionaldehyde diethyl acetal
ethyl vanillin diethyl acetal
formaldehyde diethyl acetal
furfural diethyl acetal
heliotropyl diethyl acetal
heptanal diethyl acetal
(Z)-4-hepten-1-al diethyl acetal
hexanal diethyl acetal
(Z)-3-hexen-1-al diethyl acetal
(E)-2-hexen-1-al diethyl acetal
alpha-hexyl cinnamaldehyde diethyl acetal
hydroxycitronellal diethyl acetal
methional diethyl acetal
2-methyl butyraldehyde diethyl acetal
(E,Z)-2,6-nonadien-1-al diethyl acetal
nonanal diethyl acetal
isononanal diethyl acetal
octanal diethyl acetal
isooctanal diethyl acetal
phenyl acetaldehyde diethyl acetal
propionaldehyde diethyl acetal
tridecanal diethyl acetal
undecanal diethyl acetal
valeraldehyde diethyl acetal
isovaleraldehyde diethyl acetal
 
Organoleptic Properties:
Odor Type: green
green almond bitter almond
Odor Description:at 100.00 %. green bitter almond
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Benzaldehyde Diethyl Acetal
Inoue Perfumery
BENZALDEHYDE DIETHYL ACETAL
Kingchem Laboratories
BENZALDEHYDE DIETHYL ACETAL
Odor: Sweet, mild, green, bitter almond
M&U International
Benzaldehyde Diethyl Acetal
Penta International
BENZALDEHYDE DIETHYLACETAL, Kosher
Santa Cruz Biotechnology
For experimental / research use only.
Benzaldehyde Diethyl Acetal
TCI AMERICA
For experimental / research use only.
Benzaldehyde Diethyl Acetal >98.0%(GC)
Vigon International
Benzaldehyde Diethyl Acetal
WholeChem
BENZALDEHYDE DEA
 
Safety Information:
Preferred SDS: View
 
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
 
Safety in Use Information:
Category: flavor and fragrance agents
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 1.70 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI): 3900 (μg/person/day)
Threshold of Concern:1800 (μg/person/day)
Structure Class: I
 
Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i).
Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm.
 average usage mg/kgmaximum usage mg/kg
Dairy products, excluding products of category 02.0 (01.0): 7.0000035.00000
Fats and oils, and fat emulsions (type water-in-oil) (02.0): 5.0000025.00000
Edible ices, including sherbet and sorbet (03.0): 10.0000050.00000
Processed fruit (04.1): 7.0000035.00000
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): --
Confectionery (05.0): 10.0000050.00000
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 5.0000025.00000
Bakery wares (07.0): 10.0000050.00000
Meat and meat products, including poultry and game (08.0): 2.0000010.00000
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): 2.0000010.00000
Eggs and egg products (10.0): --
Sweeteners, including honey (11.0): --
Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 5.0000025.00000
Foodstuffs intended for particular nutritional uses (13.0): 10.0000050.00000
Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 5.0000025.00000
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 10.0000050.00000
Ready-to-eat savouries (15.0): 20.00000100.00000
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 5.0000025.00000
 
Safety References:
European Food Safety Athority(efsa):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...

European Food Safety Authority (EFSA) reference(s):

Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) on a request from the Commission related to Flavouring Group Evaluation 20 (FGE.20): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical group 23
View page or View pdf

Flavouring Group Evaluation 54 (FGE.54)[1] - Consideration of benzyl derivatives evaluated by JECFA (57th meeting) structurally related to benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters evaluated by EFSA in FGE.20 (2005) - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food
View page or View pdf

Flavouring Group Evaluation 20, Revision 1 (FGE.20Rev1): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters from chemical group 23
View page or View pdf

Flavouring Group Evaluation 54, Revision 1 (FGE.54Rev1): Consideration of benzyl derivatives evaluated by JECFA (57th meeting) structurally related to benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters evaluated by EFSA in FGE.20Rev1 (2009)
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 20, Revision 2 (FGE.20Rev2): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical groups 23 and 30
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 20, Revision 3(FGE.20Rev3): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical groups 23 and 30
View page or View pdf

EPI System: View
EPA Substance Registry Services (TSCA):774-48-1
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :69884
National Institute of Allergy and Infectious Diseases:Data
diethoxymethylbenzene
Chemidplus:0000774481
 
References:
 diethoxymethylbenzene
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:774-48-1
Pubchem (cid):69884
Pubchem (sid):135026168
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (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
Export Tariff Code:2911.00.5000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
anisic
ortho-
acetanisole
FL/FR
ortho-
anisaldehyde
FL/FR
balsamic
2-
acetyl furan
FL/FR
bready
furfural
FL/FR
buttery
3,4-
hexane dione
FL/FR
caramellic
geranyl crotonate
FR
chocolate
chocolate pyrazine A
FL/FR
2-
methoxy-3-methyl pyrazine
FL/FR
floral
acetophenone
FL/FR
phenyl acetaldehyde diisobutyl acetal
FL/FR
fruity
bitter
almond oil
FL/FR
benzaldehyde
FL/FR
benzaldehyde / methyl anthranilate schiff's base
FR
benzaldehyde glycrol acetal
FL/FR
2-
benzofuran carboxaldehyde
FL/FR
bread thiophene
FL/FR
cyclohexyl cinnamate
FL/FR
4-
ethyl benzaldehyde
FL/FR
3-
methyl-2-butenal
FL/FR
tolualdehyde glyceryl acetal
FL/FR
green
benzaldehyde dimethyl acetal
FL/FR
(E)-3-
hexen-1-ol
FL/FR
phenyl acetaldehyde diethyl acetal
FL/FR
honey
methyl phenyl acetate
FL/FR
phenyl pyruvic acid
FL/FR
naphthyl
2,4-
dimethyl benzaldehyde
FL/FR
nutty
3,5-
cocoa pyrazine
FL/FR
2-
methyl-3-(methyl thio) pyrazine
FL/FR
2-
methyl-3-ethoxypyrazine
FL/FR
phenolic
methyl benzoate
FL/FR
powdery
dibenzyl ketone
FL/FR
For Flavor
No flavor group found for these
chocolate pyrazine A
FL/FR
chocolate pyrazine B
FL
cyclohexyl cinnamate
FL/FR
4-
ethyl benzaldehyde
FL/FR
5-
ethyl-2-thiophene carboxaldehyde
FL
2-
hexenal
FL
4-
methyl salicylaldehyde
FL
2-
methyl-3-(methyl thio) pyrazine
FL/FR
2-
methyl-3-ethoxypyrazine
FL/FR
phenyl acetaldehyde diethyl acetal
FL/FR
tolualdehyde glyceryl acetal
FL/FR
anisic
anisic
ortho-
anisaldehyde
FL/FR
bitter
dibenzyl ketone
FL/FR
brown
furfural
FL/FR
buttery
3,4-
hexane dione
FL/FR
floral
methyl phenyl acetate
FL/FR
fruity
bitter
almond oil
FL/FR
benzaldehyde
FL/FR
benzaldehyde glycrol acetal
FL/FR
bread thiophene
FL/FR
cherry laurel oil
FL
2,4-
hexadien-1-ol
FL
3-
methyl-2-butenal
FL/FR
green
benzaldehyde dimethyl acetal
FL/FR
(E)-3-
hexen-1-ol
FL/FR
phenyl acetaldehyde diisobutyl acetal
FL/FR
naphthyl
2,4-
dimethyl benzaldehyde
FL/FR
nutty
2-
acetyl furan
FL/FR
2-
benzofuran carboxaldehyde
FL/FR
3,5(6)-
cocoa pyrazine
FL
3,5-
cocoa pyrazine
FL/FR
2-
methoxy-3-methyl pyrazine
FL/FR
phenolic
methyl benzoate
FL/FR
phenyl pyruvic acid
FL/FR
powdery
ortho-
acetanisole
FL/FR
acetophenone
FL/FR
powdery ketone
FL
 
Potential Uses:
FRacacia
FRagrumen aldehyde
FLalmond toasted almond
FRamaryllis
FRapple green apple
FL/FRasafoetida
FLasparagus
FRbasil oil replacer
FRboxwood blossom
FRboxwood berry
FL/FRcajeput
FLcherry maraschino cherry
FL/FRcilantro
FRclary sage oil replacer
FRclematis
 cortex
FRcostus
FL/FRcurrant bud absolute replacer
FRdaffodil
FRevergreen
FRfern
 foliage
FRgreen leaf
FRguava
FRhyacinth
FRhydrangea
FRivy
FRjonquil
 leaf
FRlotus
FL/FRmarjoram
FRmimosa
FRnarcissus
FRoregano
FRpansy
FL/FRparsley leaf
 pea green pea
FLpear prickly pear
FLpepper bell pepper
FL/FRpine scotch pine
 privet
 privet blossom
FRreseda
FRrhubarb
FRrose geranium
FL/FRrose leaf
 stem
 strawberry leaf
FL/FRvalerian
FLvegetable
 vegetation tropical hothouse vegetation
 weedy
 
Occurrence (nature, food, other):note
 potato
Search Trop Picture
 
Synonyms:
 benzaldehyde diethylacetal
 benzaldehyde, diethyl acetal
 benzene, (diethoxymethyl)-
(diethoxymethyl) benzene
(diethoxymethyl)benzene
 diethoxymethylbenzene
alpha,alpha-diethoxytoluene
 toluene, a,a-diethoxy-
 

Articles:

PubMed:Synthesis and properties of 5,10,15,20-tetrakis[4-(alkoxysilyl)phenyl]porphyrins: an application of selective deprotection of benzaldehyde diethyl acetals in the presence of alkoxysilyl groups.
PubMed:Iron-mediated carboarylation/cyclization of propargylanilines with acetals: a concise route to indeno[2,1-c]quinolines.
PubMed:Microbial populations of Botrytis cinerea-inoculated strawberry fruit exposed to four volatile compounds.
PubMed:Synthesis and antitumor activity of tropolone derivatives.
PubMed:Ruthenium complexes with chiral tetradentate imino-sulfoxide ligands.
PubMed:Synthesis and antitumor activity of tropolone derivatives. 4.
 
Notes:
None found
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