We have found 46587 results matching your criteria.
Please wait while we search...
  1. 1.
    General Material Information
  2. 2.
    PhysChem Properties
  3. 3.
    Occurrences
  4. 4.
    Organoleptic Properties
  5. 5.
    Suppliers
  6. 6.
    Potential Uses
  7. 7.
    Regulatory & Documentation
  8. 8.
    Safety Information
  9. 9.
    Other Information
  10. 10.
    Blenders & Components
  11. 11.
    Literature & References

2(4)-isobutyl-4(2),6-dimethyl dihydro-4H-1,3,5-dithiazine

General Material Information

Preferred name 2(4)-isobutyl-4(2),6-dimethyl dihydro-4H-1,3,5-dithiazine
Trivial Name 4,6-dimethyl-2-(2-methylpropyl)-1,3,5-dithiazinane
Short Description 2-isobutyl-4,6-dimethyldihydro-1,3,5-dithiazine and 4-isobutyl-2,6-dimethyldihydro-1,3,5-dithiazine (mixture)
Formula C9 H19 N S2
CAS Number 101517-87-7
CAS Number 101517-86-6
Flavis Number 15.079
FDA UNII YOR3E7P831
MDL MFCD10000649
xLogP3-AA 3.80 (est)
NMR Predictor External link
JECFA Food Flavoring 1046 2-isobutyl-4,6-dimethyldihydro-1,3,5-dithiazine and 4-isobutyl-2,6-dimethyldihydro-1,3,5-dithiazine (mixture)
FDA Patent No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm 977161-98-0 ; 2(4)-ISOBUTYL-4(2),6-DIMETHYLDIHYDRO-4H-1,3,5-DITHIAZINE
Synonyms
  • 2-iso butyl-4,6-dimethyl-1,3,5-dithiazinane
  • 2-iso butyl-4,6-dimethyldihydro-1,3,5-dithiazine and 4-isobutyl-2,6-dimethyldihydro-1,3,5-dithiazine (mixture)
  • 2-iso butyl-4,6-dimethyldihydro-4h-1,3,5-dithiazine
  • 2(4)-iso butyl-4(2)-6-dimethyldihydro(4H)-1,3,5-dithiazine
  • 2(4)-iso butyl-4(2),6-dimethyldihydro-4H-1,3,5-dithiazine
  • dihydro-2-isobutyl-4,6-dimethyl-4H-1,3,5-dithiazine + dihydro-6-isobutyl-2,4-dimethyl-4H-1,3,5-dithiazine
  • 4,6-dimethyl-2-(2-methylpropyl)-1,3,5-dithiazinane
  • dimethylisobutyldihydro-1,3,5-dithiazine

US / EU / FDA / JECFA / FEMA / Scholar / Patents

Google Scholar Start search
Google Books Start search
Google Patents Start search
Perfumer & Flavorists Start search
EU Patents Start search
PubMeb Start search
NCBI Start search

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
FDA Substances Added to Food (formerly EAFUS):View
HMDB (The Human Metabolome Database):HMDB40335
FooDB:FDB020060
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 205.38743591309
Specific gravity @ 25 °C
Pounds per Gallon 7.996 to 8.046
Refractive Index 1.488 to 1.492 @ 20 °C
Boiling Point 104 to 115°C @ 2.5 mm Hg
Boiling Point 298 to 300°C @ 760 mm Hg
Vapor Pressure 0.001 mmHg @ 25 °C
Flash Point TCC Value 136.67 °C TCC
logP (o/w) 1.896 est
Solubility
alcohol Yes
water, 1562 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Nutty
roasted, cocoa, peanut, nutty
General comment At 0.10 % in dipropylene glycol. roasted cocoa peanut

Occurrences

Potential Uses

Applications
Flavoring purposes Chocolate, Peanut

Safety Information

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:
flavoring agents
Recommendation for 2(4)-isobutyl-4(2),6-dimethyl dihydro-4H-1,3,5-dithiazine usage levels up to:
not for fragrance use.
Maximised Survey-derived Daily Intakes (MSDI-EU): .10 (μg/capita/day)
Threshold of Concern:90 (μg/person/day)
Structure Class: III
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: 16
Click here to view publication 16
average usual ppmaverage maximum ppm
baked goods: 0.500005.00000
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: 0.500005.00000
cheese: --
chewing gum: 1.0000020.00000
condiments / relishes: --
confectionery froastings: 0.500005.00000
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: 0.500005.00000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: 0.500005.00000
milk products: 0.500001.00000
nut products: 0.500005.00000
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: 0.500005.00000
soft candy: 0.500005.00000
soups: 0.100002.00000
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):

Flavouring Group Evaluation 21, Revision 1 (FGE.21Rev1): Thiazoles, thiophene, thiazoline and thienyl derivatives from chemical group 29 Miscellaneous substances from chemical group 30
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 21, Revision 3 (FGE.21Rev3): Thiazoles, thiophenes, thiazoline and thienyl derivatives from chemical groups 29 and 30
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 21, Revision 4 (FGE.21Rev4): Thiazoles, thiophenes, thiazoline and thienyl derivatives from chemical groups 29 and 30
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 21, Revision 5 (FGE.21Rev5): Thiazoles, thiophenes, thiazoline and thienyl derivatives from chemical groups 29 and 30
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 9, Revision 6 (FGE.09Rev6): Secondary alicyclic saturated and unsaturated alcohols, ketones and esters containing secondary alicyclic alcohols from chemical group 8 and 30, and an ester of a phenol derivative from chemical group 25
View page or View pdf

EPI System: View
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :529056
National Institute of Allergy and Infectious Diseases:Data
4,6-dimethyl-2-(2-methylpropyl)-1,3,5-dithiazinane
Chemidplus:0101517877
2,4-dimethyl-6-(2-methylpropyl)-1,3,5-dithiazinane
Chemidplus:0101517866