EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

phenyl acetaldehyde 2,3-butylene glycol acetal
phenylacetaldehyde 2,3-butylene glycol acetal

Sponsors

Name:4,5-dimethyl-2-(phenylmethyl)-1,3-dioxolane
CAS Number: 5468-06-4Picture of molecule3D/inchi
Nikkaji Web:J1.536.383E
CoE Number:669
XlogP3-AA:2.70 (est)
Molecular Weight:192.25792000
Formula:C12 H16 O2
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome or firefox)
EFSA/JECFA Comments:
According to the JECFA: Min. assay value is "93 %" and secondary components "butane-2,3-diol". Racemate. Secondary component: butane-2,3-diol (2-3 %) (EFFA, 2010a).
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
JECFA Food Flavoring:1005 phenylacetaldehyde 2,3-butylene glycol acetal
FLAVIS Number:06.027 (Old)
DG SANTE Food Flavourings:06.027 4,5-dimethyl-2-benzyl-1,3-dioxolane
FEMA Number:2875 phenylacetaldehyde 2,3-butylene glycol acetal
FDA Mainterm: PHENYLACETALDEHYDE 2,3-BUTYLENE GLYCOL ACETAL
FDA Regulation:
FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION
Subpart F--Flavoring Agents and Related Substances
Sec. 172.515 Synthetic flavoring substances and adjuvants.
 
Physical Properties:
Appearance:colorless clear viscous liquid (est)
Assay: 93.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:1.03000 to 1.04000 @ 25.00 °C.
Pounds per Gallon - (est).: 8.571 to 8.654
Refractive Index:1.49600 to 1.51200 @ 20.00 °C.
Boiling Point: 263.00 to 264.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.016000 mm/Hg @ 25.00 °C. (est)
Flash Point: 243.00 °F. TCC ( 117.22 °C. )
logP (o/w): 2.659 (est)
Soluble in:
 alcohol
 water, 259.6 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:medium
floral sweet earthy
Odor Description:at 100.00 %. floral sweet earthy
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the Chemical Sources Association
 
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
 
Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for phenyl acetaldehyde 2,3-butylene glycol acetal usage levels up to:
  1.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.12 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 1.00 (μg/capita/day)
Structure Class: I
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 3
 average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: -4.00000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --
 
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 14 (FGE.14): Phenethyl alcohol, aldehyde, esters, and related phenylacetic acid esters from chemical group 15 (Commission Regulation (EC) No 1565/2000 of 18 July 2000)
View page or View pdf
Flavouring Group Evaluation 53 (FGE.53): Consideration of phenethyl alcohol, aldehyde, acid and related acetals and esters evaluated by JECFA (59th meeting) structurally related to phenethyl alcohol, aldehyde, esters and related phenylacetic acid esters evaluated by EFSA in FGE.14 (2005) and one phenoxyethyl ester evaluated in FGE.23 (2006) (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC)
View page or View pdf
Flavouring Group Evaluation 14, Revision 1 (FGE.14Rev1): Phenethyl alcohol, aldehyde, acetals, carboxylic acid and related esters from chemical group 15 and 22 [1] - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food
View page or View pdf
Flavouring Group Evaluation 53, Revision 1 (FGE.53Rev1): Consideration of phenethyl alcohol, aldehyde, acid and related acetals and esters evaluated by JECFA (59th meeting) FGE.23Rev1 (2008)
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 96 (FGE.96): Consideration of 88 flavouring substances considered by EFSA for which EU production volumes / anticipated production volumes have been submitted on request by DG SANCO. Addendum to FGE. 51, 52, 53, 54, 56, 58, 61, 62, 63, 64, 68, 69, 70, 71, 73, 76, 77, 79, 80, 83, 84, 85 and 87.
View page or View pdf
EPI System: View
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :230525
National Institute of Allergy and Infectious Diseases:Data
4,5-dimethyl-2-(phenylmethyl)-1,3-dioxolane
Chemidplus:0005468064
 
References:
 4,5-dimethyl-2-(phenylmethyl)-1,3-dioxolane
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:5468-06-4
Pubchem (cid):230525
Pubchem (sid):135263461
 
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
FDA Everything Added to Food in the United States (EAFUS):View
HMDB (The Human Metabolome Database):HMDB39841
FooDB:FDB019495
Export Tariff Code:2911.00.5000
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aldehydic
nonanal diethyl acetal
FL/FR
balsamic
brachyleana hutchinsii wood oil
FR
caramellic
propyl pyruvate
FL/FR
citrus
2-
heptanol
FL/FR
earthy
1-
octen-3-ol
FL/FR
ethereal
ethyl formate
FL/FR
fatty
undecanal propylene glycol acetal
FL/FR
floral
iso
amyl undecylenate
FL/FR
benzyl alcohol
FL/FR
butyl benzyl ether
FL/FR
citronellal
FL/FR
citronellyl acetate
FL/FR
citronellyl propionate
FL/FR
(Z)-alpha-
damascone
FL/FR
gamma-
damascone
FR
(Z)-4-
decen-1-yl acetate
FL/FR
dihydrocarvyl acetate
FL/FR
dimethyl benzyl carbinol
FL/FR
farnesyl acetate
FL/FR
floral pyran
FR
geranyl acetate
FL/FR
geranyl formate
FL/FR
(E)-
geranyl linalool
FL/FR
hawthorn ethanol
FR
heliotropyl diethyl acetal
FR
lilac specialty
FR
linalool oxide
FL/FR
2-
methyl octanal
FL/FR
2-
methyl-4-phenyl butanal
FL/FR
muguet carbinol
FL/FR
musk acetate
FR
narcissus acetate
FL/FR
neryl acetate
FL/FR
neryl isovalerate
FL/FR
nonanol
FL/FR
bitter
orangeflower concrete morocco
FR
phenethyl acetate
FL/FR
phenethyl anthranilate
FL/FR
phenethyl formate
FL/FR
phenethyl lactate
FL/FR
phenethyl phenyl acetate
FL/FR
phenethyl salicylate
FL/FR
phenyl acetaldehyde digeranyl acetal
FR
phenyl propyl phenyl acetate
FR
(E)-2-
phenyl-1(2)-propene-1-yl acetate
FR
laevo-
rose oxide
FL/FR
(Z)-
rose oxide
FL/FR
rose pyran
FR
styralyl propionate
FL/FR
tuberose absolute (from concrete)
FL/FR
tuberose absolute (from pommade)
FL/FR
(E)-2-
undecen-1-ol
FL/FR
2-
undecen-1-ol
FL/FR
fruity
iso
butyl anthranilate
FL/FR
butyl propionate
FL/FR
cyclohexyl crotonate
FR
(E)-alpha-
damascone
FL/FR
strawberry glycidate 2
FL/FR
tropical trithiane
FL/FR
fungal
hydroxymethyl hexyl ethyl ketone
FL/FR
green
iso
decanal
FL/FR
earthy acetal
FL/FR
geranium absolute
FL/FR
(Z)-3-
hexen-1-yl phenyl acetate
FL/FR
hexoxyacetaldehyde dimethyl acetal
FR
methyl cyclocitrone (IFF)
FR
octyl oxyacetaldehyde
FR
phenethyl isopropyl ether
FR
phenethyl oxyacetaldehyde
FR
phenethyl tiglate
FL/FR
phenyl acetaldehyde
FL/FR
1-
phenyl-2-pentanol
FL/FR
3,5,5-
trimethyl hexanol
FL/FR
herbal
6-
hydroxydihydrotheaspirane (mixture of isomers)
FL/FR
honey
phenyl acetic acid
FL/FR
leathery
leather cyclohexanol
FR
musk
musk gx 100%
FR
musk gx 50% in BB
FR
musk gx 50% in DEP
FR
naphthyl
ortho-
methyl anisole
FL/FR
spicy
(E)-para-
methoxycinnamaldehyde
FL/FR
terpenic
(E,E)-2,6-allo
ocimene
FL/FR
woody
(E)-
ethyl geranate
FR
4,6,11-
trimethyl-5-oxatricyclo(6.2.2.0*4,9*)dodec-6-ene
FR
For Flavor
No flavor group found for these
iso
amyl undecylenate
FL/FR
benzyl disulfide
FL
butyl benzyl ether
FL/FR
(Z)-alpha-
damascone
FL/FR
iso
decanal
FL/FR
(Z)-4-
decen-1-yl acetate
FL/FR
earthy acetal
FL/FR
(E)-
geranyl linalool
FL/FR
hydroxymethyl hexyl ethyl ketone
FL/FR
(E)-para-
methoxycinnamaldehyde
FL/FR
2-
methyl octanal
FL/FR
2-
methyl-4-phenyl butanal
FL/FR
narcissus acetate
FL/FR
nonanal diethyl acetal
FL/FR
(E,E)-2,6-allo
ocimene
FL/FR
phenethyl lactate
FL/FR
propyl pyruvate
FL/FR
undecanal propylene glycol acetal
FL/FR
2-
undecen-1-ol
FL/FR
(E)-2-
undecen-1-ol
FL/FR
camphoreous
camphoreous
6-
hydroxydihydrotheaspirane (mixture of isomers)
FL/FR
ortho-
methyl anisole
FL/FR
citrus
styralyl propionate
FL/FR
ethereal
ethyl formate
FL/FR
floral
citronellal
FL/FR
citronellyl acetate
FL/FR
citronellyl propionate
FL/FR
dihydrocarvyl acetate
FL/FR
farnesyl acetate
FL/FR
muguet carbinol
FL/FR
neryl acetate
FL/FR
phenethyl anthranilate
FL/FR
phenyl acetic acid
FL/FR
laevo-
rose oxide
FL/FR
tuberose absolute (from concrete)
FL/FR
tuberose absolute (from pommade)
FL/FR
fruity
benzyl alcohol
FL/FR
iso
butyl anthranilate
FL/FR
butyl propionate
FL/FR
(E)-alpha-
damascone
FL/FR
2-
heptanol
FL/FR
methyl 4-phenyl butyrate
FL
neryl isovalerate
FL/FR
1-
phenyl-2-pentanol
FL/FR
strawberry glycidate 2
FL/FR
tropical trithiane
FL/FR
green
geranium absolute
FL/FR
geranyl acetate
FL/FR
geranyl formate
FL/FR
(Z)-3-
hexen-1-yl phenyl acetate
FL/FR
linalool oxide
FL/FR
phenethyl formate
FL/FR
phenethyl tiglate
FL/FR
propylene glycol acetone ketal
FL
(Z)-
rose oxide
FL/FR
3,5,5-
trimethyl hexanol
FL/FR
honey
phenethyl acetate
FL/FR
phenethyl phenyl acetate
FL/FR
phenyl acetaldehyde
FL/FR
medicinal
dimethyl benzyl carbinol
FL/FR
phenethyl salicylate
FL/FR
mushroom
1-
octen-3-ol
FL/FR
waxy
nonanol
FL/FR
 
Potential Uses:
FRearth humus
 fir
FRfloral
FRorris iris
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
2-benzyl-4,5-dimethyl-1,3-dioxolane
4,5-dimethyl-2-(phenyl methyl)-1,3-dioxolane
4,5-dimethyl-2-(phenylmethyl)-1,3-dioxolane
4,5-dimethyl-2-benzyl-1,3-dioxolane
1,3-dioxolane, 4,5-dimethyl-2-(phenylmethyl)-
 phenylacetaldehyde 2,3-butylene glycol acetal
 phenylacetaldehyde 2,3-butyleneglycol acetal
 

Articles:

 None found yet.
 
Notes:
Flavouring ingredient for baked goods, puddings, candies and nonalcoholic beverages Tiaprofenic acid is a non-steroidal anti-inflammatory drug of the arylpropionic acid (profen) class, used to treat pain, especially arthritic pain. The typical adult dose is 300mg twice daily. It is not recommended in children.
Please share your Comments.
Email Address:
Top of Page Home
Copyright © 1980-2018 The Good Scents Company (tgsc) ™ Disclaimer Privacy Policy