nonanal diethyl acetal
aldehyde C-9 diethyl acetal
 
Notes:
None found
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      Product(s):
      N0956 Nonanal Diethyl Acetal >98.0%(GC)
       
Synonyms   Articles   Notes   Search
1,1-diethoxynonane (Click)
CAS Number: 54815-13-3Picture of molecule
ECHA EINECS - REACH Pre-Reg: 259-360-4
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 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: 06.065 (Old)
DG SANTE Food Flavourings: 06.065  1,1-diethoxynonane
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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 mm/Hg @ 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
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Organoleptic Properties:
 
Odor Type: aldehydic
 
Odor Strength: medium ,
recommend smelling in a 10.00 % solution or less
 
 aldehydic  floral  rose  
Odor Description:
at 10.00 % in dipropylene glycol. 
aldehydic floral rose
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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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)
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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
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
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
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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
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
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References:
 1,1-diethoxynonane
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 54815-13-3
Pubchem (cid): 108625
Pubchem (sid): 135065547
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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
Typical G.C.
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
No odor group found for these
 citronitrile (Symrise)FR
aldehydic
 adoxal (Givaudan)FL/FR
isobutyraldehydeFL/FR
 citronellyl oxyacetaldehydeFL/FR
 citrus carbaldehydeFR
6,7,8-decen-1-olFR
 nonanal (aldehyde C-9)FL/FR
 TMH aldehydeFR
 undecanalFL/FR
chocolate
isoamyl phenyl acetateFL/FR
citrus
 abronia fragranceFR
 citrus specialtyFR
2-methyl decanal (aldehyde C-11 MOA)FL/FR
bitter orange peel oil terpenelessFL/FR
fatty
2-decenalFL/FR
 methyl 10-undecenoateFL/FR
floral
alpha-amyl cinnamaldehyde diethyl acetalFR
isoamyl undecylenateFL/FR
 benzyl alcoholFL/FR
 butyl benzyl etherFL/FR
3-(3-tert-butyl phenyl) propanal 
 citronellalFL/FR
laevo-citronellolFL/FR
 citronellyl anthranilateFL/FR
 citronellyl ethoxalateFR
 citronellyl propionateFL/FR
para-cresyl phenyl ether 
gamma-damasconeFR
(Z)-alpha-damasconeFL/FR
(Z)-4-decen-1-yl acetateFL/FR
 dihydrocarvyl acetateFL/FR
 ethyl phenoxyacetateFR
 farnesyl acetateFL/FR
 floral pyranFR
 geranium oil egyptFL/FR
 geranium oil egypt fractionsFR
 geranium oil terpenelessFL/FR
 geranium petiole oil indiaFL/FR
 geranium rose oilFL/FR
 geranium rose-scented oil cubaFR
 geranyl acetateFL/FR
(E)-geranyl linaloolFL/FR
 globulol 
 glycoacetalFR
 hawthorn ethanolFR
 heptanal cyclic trimethylene acetal 
 magnolia decadienalFR
2-methyl octanalFL/FR
3-methyl-6-ethyl-5-octen-1-olFR
 musk acetateFR
 neryl acetateFL/FR
 neryl isovalerateFL/FR
 nonanal / methyl anthranilate schiff's baseFR
 nonanolFL/FR
 octyl isovalerateFL/FR
 peony alcoholFR
 phenethyl acetateFL/FR
 phenethyl alcoholFL/FR
 phenethyl anthranilateFL/FR
 phenethyl heptanoateFL/FR
 phenethyl lactateFL/FR
 phenethyl phenyl acetateFL/FR
 phenethyl salicylateFL/FR
 phenyl acetaldehyde digeranyl acetalFR
 primrose fragranceFR
 rhodinol substituesFL/FR
 rhodinyl acetate substitutesFL/FR
 rosa alba flower oil CO2 extractFR
 rose absolute (rosa centifolia)FL/FR
 rose absolute (rosa centifolia) moroccoFL/FR
 rose absolute (rosa damascena) bulgariaFL/FR
 rose absolute (rosa damascena) turkeyFL/FR
 rose absolute pentanolFR
 rose acetateFR
 rose blossom pentanolFR
 rose butanoateFL/FR
 rose concrete (rosa centifolia)FR
 rose concrete (rosa damascena)FR
 rose oil (rosa centifolia) egyptFL/FR
 rose oil (rosa damascena) bulgariaFL/FR
 rose oil (rosa damascena) iranFL/FR
 rose oil (rosa damascena) turkeyFL/FR
 rose oil replacerFR
laevo-rose oxideFL/FR
 rose pyranFR
 styralyl propionateFL/FR
(E)-2,5,9-trimethyl-4,9-decadien-1-alFR
(E)-2-undecen-1-olFL/FR
2-undecen-1-olFL/FR
fruity
(E)-alpha-damasconeFL/FR
(R)-gamma-dodecalactoneFL/FR
 ethyl para-methyl-beta-phenyl glycidateFR
(E)-ethyl tiglateFL/FR
 plum crotonateFR
 strawberry glycidate 2FL/FR
green
isodecanalFL/FR
 flower hexeneFR
2-heptyl tetrahydrofuranFR
(Z)-3-hexen-1-yl phenyl acetateFL/FR
[(4E,4Z)-5-methoxy-3-methyl-4-penten-1-yl] benzeneFR
 phenyl acetaldehydeFL/FR
 phenyl acetaldehyde dimethyl acetalFL/FR
herbal
 chamomile valerateFR
 eucalyptus citriodora oilFR
laevo-menthyl propionateFL/FR
 rose oil (rosa centifolia) moroccoFL/FR
honey
 phenyl acetic acidFL/FR
powdery
para-anisyl alcoholFL/FR
spicy
 maja fragranceFR
 pepper hexanoneFR
waxy
(E)-5-decen-1-ol 
 
For Flavor
 
No flavor group found for these
isoamyl undecylenateFL/FR
 butyl benzyl etherFL/FR
3-(3-tert-butyl phenyl) propanal 
(Z)-alpha-damasconeFL/FR
isodecanalFL/FR
(E)-5-decen-1-ol 
(Z)-4-decen-1-yl acetateFL/FR
(R)-gamma-dodecalactoneFL/FR
(E)-geranyl linaloolFL/FR
 globulol 
 heptanal cyclic trimethylene acetal 
3-heptyl acetateFL
laevo-menthyl propionateFL/FR
2-methyl octanalFL/FR
 octyl isovalerateFL/FR
 phenethyl heptanoateFL/FR
 phenethyl lactateFL/FR
 rhodinyl acetate substitutesFL/FR
 rose absolute (rosa damascena) bulgariaFL/FR
 rose absolute (rosa damascena) turkeyFL/FR
2-undecen-1-olFL/FR
(E)-2-undecen-1-olFL/FR
(E)-4-undecenalFL
aldehydic
isobutyraldehydeFL/FR
 nonanal (aldehyde C-9)FL/FR
berry
 rhodinol substituesFL/FR
citrus
 citronellyl oxyacetaldehydeFL/FR
2-methyl decanal (aldehyde C-11 MOA)FL/FR
bitter orange peel oil terpenelessFL/FR
 styralyl propionateFL/FR
fatty
2-decenalFL/FR
floral
isoamyl phenyl acetateFL/FR
 citronellalFL/FR
laevo-citronellolFL/FR
 citronellyl propionateFL/FR
 dihydrocarvyl acetateFL/FR
 farnesyl acetateFL/FR
 geranium oil egyptFL/FR
 geranium oil terpenelessFL/FR
 geranium petiole oil indiaFL/FR
 geranium rose oilFL/FR
 neryl acetateFL/FR
 phenethyl alcoholFL/FR
 phenethyl anthranilateFL/FR
 phenyl acetic acidFL/FR
 rose absolute (rosa centifolia)FL/FR
 rose absolute (rosa centifolia) moroccoFL/FR
 rose oil (rosa centifolia) egyptFL/FR
 rose oil (rosa damascena) bulgariaFL/FR
 rose oil (rosa damascena) iranFL/FR
 rose oil (rosa damascena) turkeyFL/FR
laevo-rose oxideFL/FR
fruity
para-anisyl alcoholFL/FR
 benzyl alcoholFL/FR
 citronellyl anthranilateFL/FR
para-cresyl phenyl ether 
(E)-alpha-damasconeFL/FR
(E)-ethyl tiglateFL/FR
 neryl isovalerateFL/FR
 rose butanoateFL/FR
 strawberry glycidate 2FL/FR
green
 geranyl acetateFL/FR
(Z)-3-hexen-1-yl phenyl acetateFL/FR
 phenyl acetaldehyde dimethyl acetalFL/FR
herbal
 rose oil (rosa centifolia) moroccoFL/FR
honey
 phenethyl acetateFL/FR
 phenethyl phenyl acetateFL/FR
 phenyl acetaldehydeFL/FR
medicinal,
 phenethyl salicylateFL/FR
waxy
 adoxal (Givaudan)FL/FR
 methyl 10-undecenoateFL/FR
 nonanolFL/FR
 undecanalFL/FR
 
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Potential Uses:
 gardeniaFR
 jasminFR
 rose tea roseFR
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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
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Synonyms:
 aldehyde C-9 diethyl acetal
1,1-diethoxy-N-nonane
1,1-diethoxynonane
 nonanal, diethyl acetal
 nonane, 1,1-diethoxy-
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