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nonanal diethyl acetal
aldehyde C-9 diethyl acetal

Supplier Sponsors

Name:1,1-diethoxynonane
CAS Number: 54815-13-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:259-360-4
FDA UNII: Search
Nikkaji Web:J105.334E
MDL:MFCD00672806
CoE Number:10016
XlogP3-AA:4.80 (est)
Molecular Weight:216.36456000
Formula:C13 H28 O2
NMR Predictor:Predict (works with chrome, Edge 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
PubMed:Search
NCBI:Search
DG SANTE Food Flavourings:06.065 1,1-diethoxynonane
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.84200 to 0.84700 @ 25.00 °C.
Pounds per Gallon - (est).: 7.006 to 7.048
Refractive Index:1.41900 to 1.42500 @ 20.00 °C.
Boiling Point: 106.00 °C. @ 13.00 mm Hg
Boiling Point: 242.00 to 243.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.053000 mmHg @ 25.00 °C. (est)
Flash Point: 145.00 °F. TCC ( 62.78 °C. )
logP (o/w): 4.588 (est)
Soluble in:
 alcohol
 water, 3.902 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
benzaldehyde 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
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: aldehydic
aldehydic floral rose
Odor Description:at 10.00 % in dipropylene glycol. aldehydic floral rose
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Apple Flavor & Fragrance
Nonanal diethyl acetal
BOC Sciences
For experimental / research use only.
Nonanal Diethyl Acetal
Inoue Perfumery
NONANAL DIETHYL ACETAL
Nagar Haveli Perfumes & Aromatics
Nonanal Diethyl Acetal
Odor: Aldehydic floral rose
TCI AMERICA
For experimental / research use only.
Nonanal Diethyl Acetal >98.0%(GC)
 
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
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for nonanal diethyl acetal usage levels up to:
  2.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.52 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI): 1600 (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): 3.0000015.00000
Fats and oils, and fat emulsions (type water-in-oil) (02.0): 2.0000010.00000
Edible ices, including sherbet and sorbet (03.0): 3.0000015.00000
Processed fruit (04.1): 2.0000010.00000
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): --
Confectionery (05.0): 4.0000020.00000
Chewing gum (05.3): --
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 2.0000010.00000
Bakery wares (07.0): 5.0000025.00000
Meat and meat products, including poultry and game (08.0): 1.000005.00000
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): 1.000005.00000
Eggs and egg products (10.0): --
Sweeteners, including honey (11.0): --
Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 2.0000010.00000
Foodstuffs intended for particular nutritional uses (13.0): 3.0000015.00000
Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 2.0000010.00000
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 4.0000020.00000
Ready-to-eat savouries (15.0): 5.0000025.00000
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 2.0000010.00000
 
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) related to Flavouring Group Evaluation 3 (FGE.03); Acetals of branched- and straight-chain aliphatic saturated primary alcohols and branched- and straight-chain saturated aldehydes, and a orthoester of formic acid, from chemical groups 1 and 2 (Commission Regulation (EC) No 1565/2000 of 18 July 2000)
View page or View pdf

Flavouring Group Evaluation 3, Revision 1 (FGE.03Rev1): Acetals of branched- and straight-chain aliphatic saturated primary alcohols and branched- and straight-chain saturated or unsaturated aldehydes, an ester of a hemiacetal and an orthoester of formic acid, from chemical groups 1, 2 & 4 Commission Regulation (EC) No 1565/2000 of 18 July 2000) [1] - Scientific Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC)on a request from the Commission
View page or View pdf

Flavouring Group Evaluation 61 (FGE.61): Consideration of aliphatic acyclic acetals evaluated by JECFA (57th meeting) structurally related to acetals of branched- and straight-chain aliphatic saturated primary alcohols and branched- and straight-chain saturated aldehydes, and an orthoester of formic acid evaluated by EFSA in FGE.03 (2004) (Commission Regulation (EC) No 1565/2000 of 18 July 2000)
View page or View pdf

Flavouring Group Evaluation 61, Revision 1 (FGE.61Rev1): Consideration of aliphatic acetals evaluated by JECFA (57th meeting) structurally related to acetals of branched- and straight-chain aliphatic saturated primary alcohols and branched- and straight-chain saturated aldehydes and one orthoester of formic acid evaluated
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 3, Revision 2 (FGE.03Rev2): Acetals of branched- and straight-chain aliphatic saturated primary alcohols and branched- and straight-chain saturated or unsaturated aldehydes, an ester of a hemiacetal and an orthoester of formic acid, from chemical groups 1, 2 and 4
View page or View pdf

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):54815-13-3
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :108625
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:1
1,1-diethoxynonane
Chemidplus:0054815133
 
References:
 1,1-diethoxynonane
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:54815-13-3
Pubchem (cid):108625
Pubchem (sid):135065547
 
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
Export Tariff Code:2911.00.5000
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aldehydic
adoxal (Givaudan)
FL/FR
iso
butyraldehyde
FL/FR
citronellyl oxyacetaldehyde
FL/FR
citrus carbaldehyde
FR
6,7,8-
decen-1-ol
FR
nonanal (aldehyde C-9)
FL/FR
TMH aldehyde
FR
undecanal
FL/FR
aromatic
aromatic woody citrus floral fragrance
FR
balsamic
callitropsis araucarioides wood oil
FR
chocolate
iso
amyl phenyl acetate
FL/FR
citrus
abronia fragrance
FR
citronella fragrance
FR
citronitrile (Symrise)
FR
citrus specialty
FR
lime fragrance
FR
lime oil distilled mexico
FL/FR
lime oil replacer
FR
lime specialty
FR
2-
methyl decanal (aldehyde C-11 MOA)
FL/FR
bitter
orange peel oil terpeneless
FL/FR
fatty
2-
decenal
FL/FR
methyl 10-undecenoate
FL/FR
floral
alpha-
amyl cinnamaldehyde diethyl acetal
FR
iso
amyl undecylenate
FL/FR
benzyl alcohol
FL/FR
butyl benzyl ether
FL/FR
citronellal
FL/FR
laevo-
citronellol
FL/FR
citronellyl anthranilate
FL/FR
citronellyl ethoxalate
FR
citronellyl propionate
FL/FR
damascate
FR
gamma-
damascone
FR
(Z)-alpha-
damascone
FL/FR
(Z)-4-
decen-1-yl acetate
FL/FR
dihydrocarvyl acetate
FL/FR
ethyl phenoxyacetate
FR
farnesyl acetate
FL/FR
floral pyran
FR
geranium oil egypt
FL/FR
geranium oil egypt fractions
FR
geranium oil terpeneless
FL/FR
geranium petiole oil india
FL/FR
geranium rose oil
FL/FR
geranium rose-scented oil cuba
FR
geranyl acetate
FL/FR
(E)-
geranyl linalool
FL/FR
glycoacetal
FR
hawthorn ethanol
FR
magnolia decadienal
FR
2-
methyl octanal
FL/FR
3-
methyl-6-ethyl-5-octen-1-ol
FR
musk acetate
FR
neryl acetate
FL/FR
neryl isovalerate
FL/FR
nonanal / methyl anthranilate schiff's base
FR
nonanol
FL/FR
octyl isovalerate
FL/FR
peony alcohol
FR
phenethyl acetate
FL/FR
phenethyl alcohol
FL/FR
phenethyl anthranilate
FL/FR
phenethyl heptanoate
FL/FR
phenethyl lactate
FL/FR
phenethyl phenyl acetate
FL/FR
phenethyl salicylate
FL/FR
phenyl acetaldehyde digeranyl acetal
FR
primrose fragrance
FR
rhodinol substitues
FL/FR
rhodinyl acetate substitutes
FL/FR
rhodinyl benzoate
FR
rosa alba flower oil CO2 extract
FR
rose absolute (rosa centifolia)
FL/FR
rose absolute (rosa centifolia) morocco
FL/FR
rose absolute (rosa damascena) bulgaria
FL/FR
rose absolute (rosa damascena) turkey
FL/FR
rose absolute pentanol
FR
rose acetate
FR
rose blossom pentanol
FR
rose butanoate
FL/FR
rose concrete (rosa centifolia)
FR
rose concrete (rosa damascena)
FR
rose oil (rosa centifolia) egypt
FL/FR
rose oil (rosa damascena) bulgaria
FL/FR
rose oil (rosa damascena) iran
FL/FR
rose oil (rosa damascena) turkey
FL/FR
rose oil replacer
FR
laevo-
rose oxide
FL/FR
rose pyran
FR
rose specialty
FR
styralyl propionate
FL/FR
(E)-2,5,9-
trimethyl-4,9-decadien-1-al
FR
(E)-2-
undecen-1-ol
FL/FR
2-
undecen-1-ol
FL/FR
fruity
(E)-alpha-
damascone
FL/FR
(R)-gamma-
dodecalactone
FL/FR
ethyl para-methyl-beta-phenyl glycidate
FR
(E)-
ethyl tiglate
FL/FR
plum crotonate
FR
strawberry glycidate 2
FL/FR
green
iso
decanal
FL/FR
flower hexene
FR
2-
heptyl tetrahydrofuran
FR
(Z)-3-
hexen-1-yl phenyl acetate
FL/FR
[(4E,4Z)-5-
methoxy-3-methyl-4-penten-1-yl] benzene
FR
phenyl acetaldehyde
FL/FR
phenyl acetaldehyde dimethyl acetal
FL/FR
herbal
chamomile valerate
FR
eucalyptus citriodora oil
FR
laevo-
menthyl propionate
FL/FR
rose oil (rosa centifolia) morocco
FL/FR
honey
phenyl acetic acid
FL/FR
powdery
para-
anisyl alcohol
FL/FR
spicy
crocus sativus stigma tincture
FR
maja fragrance
FR
pepper hexanone
FR
For Flavor
No flavor group found for these
iso
amyl undecylenate
FL/FR
butyl benzyl ether
FL/FR
(Z)-alpha-
damascone
FL/FR
iso
decanal
FL/FR
(Z)-4-
decen-1-yl acetate
FL/FR
(R)-gamma-
dodecalactone
FL/FR
(E)-
geranyl linalool
FL/FR
3-
heptyl acetate
FL
laevo-
menthyl propionate
FL/FR
2-
methyl octanal
FL/FR
octyl isovalerate
FL/FR
phenethyl heptanoate
FL/FR
phenethyl lactate
FL/FR
rhodinyl acetate substitutes
FL/FR
2-
undecen-1-ol
FL/FR
(E)-2-
undecen-1-ol
FL/FR
(E)-4-
undecenal
FL
aldehydic
aldehydic
iso
butyraldehyde
FL/FR
nonanal (aldehyde C-9)
FL/FR
berry
rhodinol substitues
FL/FR
citrus
citronellyl oxyacetaldehyde
FL/FR
lime oil distilled mexico
FL/FR
2-
methyl decanal (aldehyde C-11 MOA)
FL/FR
bitter
orange peel oil terpeneless
FL/FR
styralyl propionate
FL/FR
fatty
2-
decenal
FL/FR
floral
iso
amyl phenyl acetate
FL/FR
citronellal
FL/FR
laevo-
citronellol
FL/FR
citronellyl propionate
FL/FR
dihydrocarvyl acetate
FL/FR
farnesyl acetate
FL/FR
geranium oil egypt
FL/FR
geranium oil terpeneless
FL/FR
geranium petiole oil india
FL/FR
geranium rose oil
FL/FR
neryl acetate
FL/FR
phenethyl alcohol
FL/FR
phenethyl anthranilate
FL/FR
phenyl acetic acid
FL/FR
rose absolute (rosa centifolia)
FL/FR
rose absolute (rosa centifolia) morocco
FL/FR
rose absolute (rosa damascena) bulgaria
FL/FR
rose absolute (rosa damascena) turkey
FL/FR
rose oil (rosa centifolia) egypt
FL/FR
rose oil (rosa damascena) bulgaria
FL/FR
rose oil (rosa damascena) iran
FL/FR
rose oil (rosa damascena) turkey
FL/FR
laevo-
rose oxide
FL/FR
fruity
para-
anisyl alcohol
FL/FR
benzyl alcohol
FL/FR
citronellyl anthranilate
FL/FR
(E)-alpha-
damascone
FL/FR
(E)-
ethyl tiglate
FL/FR
neryl isovalerate
FL/FR
rose butanoate
FL/FR
strawberry glycidate 2
FL/FR
green
geranyl acetate
FL/FR
(Z)-3-
hexen-1-yl phenyl acetate
FL/FR
phenyl acetaldehyde dimethyl acetal
FL/FR
herbal
rose oil (rosa centifolia) morocco
FL/FR
honey
phenethyl acetate
FL/FR
phenethyl phenyl acetate
FL/FR
phenyl acetaldehyde
FL/FR
medicinal,
phenethyl salicylate
FL/FR
waxy
adoxal (Givaudan)
FL/FR
methyl 10-undecenoate
FL/FR
nonanol
FL/FR
undecanal
FL/FR
 
Potential Uses:
FRgardenia
FRjasmin
FRrose tea rose
 
Occurrence (nature, food, other):note
 cider - 0.05 mg/kg
Search PMC Picture
 cognac - 0.01 mg/kg
Search PMC Picture
 rum - 10 mg/kg
Search PMC Picture
 star fruit oil cuba @ 0.10%
Data GC Search Trop Picture
 
Synonyms:
 aldehyde C-9 diethyl acetal
1,1-diethoxy-N-nonane
1,1-diethoxynonane
 nonanal, diethyl acetal
 nonane, 1,1-diethoxy-
 
 
Notes:
None found
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