Name: | 2',3a-dimethylspiro[6,6a-dihydro-5H-[1,3]dithiolo[4,5-b]furan-2,3'-oxolane] |
CAS Number: | 38325-25-6 | 3D/inchi
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ECHA EINECS - REACH Pre-Reg: | 253-884-7 |
FDA UNII: | TER5ZXE00D |
Nikkaji Web: | J294.644K |
CoE Number: | 2325 |
XlogP3-AA: | 2.10 (est) |
Molecular Weight: | 232.36592000 |
Formula: | C10 H16 O2 S2 |
NMR Predictor: | Predict (works with chrome, Edge or firefox) |
EFSA/JECFA Comments: |
Stereoisomeric composition to be specified. Composition of mixture to be specified.
Composition of structural isomers, I: 65 %, II: 35 %. Mixture of stereoisomers (Flavour Industry, 2012c). |
Category:flavoring agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Physical Properties:
Appearance: | colorless to pale yellow clear liquid (est) |
Assay: | 95.00 to 100.00
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Food Chemicals Codex Listed: | No |
Specific Gravity: | 1.20000 to 1.20800 @ 25.00 °C.
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Pounds per Gallon - (est).: | 9.985 to 10.052
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Refractive Index: | 1.55900 to 1.56500 @ 20.00 °C.
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Boiling Point: | 135.00 to 140.00 °C. @ 3.00 mm Hg
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Vapor Pressure: | 0.000050 mmHg @ 25.00 °C. (est) |
Flash Point: | 337.00 °F. TCC ( 169.44 °C. )
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logP (o/w): | 2.832 (est) |
Soluble in: |
| alcohol | | water, 68.67 mg/L @ 25 °C (est) |
Insoluble in: |
| water |
Organoleptic Properties:
Flavor Type: meaty |
meaty |
Taste Description: meaty |
Odor and/or flavor descriptions from others (if found). |
Cosmetic Information:
Suppliers:
BOC Sciences |
For experimental / research use only. |
Hexahydro-2'3a-dimethylspiro[1,3-dithiolo[4,5-b]furan-2,3'(2'H)-furan] 95%
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Parchem |
2',3-dimethyl-3',4-dioxa-2,8-dithiabicyclo(3.3.0)octane spirocyclopentane
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Penta International |
SPIRO[2,4-DITHIA-1-METHYL-8-OXABICYCLO-[3.3.0] -OCTANE-3,3-1
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Shijiazhuang Donglian Nankai Aroma Chemicals |
Hexahydro-2'3a-dimethylspiro[1,3-dithiolo[4,5-b]furan-2,3'(2'h)-furan]
Odor: Aromatic meat |
Chemical Sources Association |
Need This Item for Flavor/Food?: You can contact the Chemical Sources Association |
Safety Information:
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Hazards identification |
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Classification of the substance or mixture |
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) |
None found. |
GHS Label elements, including precautionary statements |
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Pictogram | |
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Hazard statement(s) |
None found. |
Precautionary statement(s) |
None found. |
Oral/Parenteral Toxicity: |
Not determined
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Dermal Toxicity: |
Not determined
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Inhalation Toxicity: |
Not determined
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Safety in Use Information:
Category: | flavoring agents |
Recommendation for 2',3-dimethyl-3',4-dioxa-2,8-dithiabicyclo(3.3.0)octane spirocyclopentane usage levels up to: | | not for fragrance use.
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Maximised Survey-derived Daily Intakes (MSDI-EU): | 6.10 (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: 5 |
Click here to view publication 5 |
| average usual ppm | average maximum ppm |
baked goods: | - | - |
beverages(nonalcoholic): | - | 0.04500 |
beverages(alcoholic): | - | - |
breakfast cereal: | - | - |
cheese: | - | - |
chewing gum: | - | - |
condiments / relishes: | - | - |
confectionery froastings: | - | - |
egg products: | - | - |
fats / oils: | - | 2.40000 |
fish products: | - | - |
frozen dairy: | - | 0.25000 |
fruit ices: | - | 0.25000 |
gelatins / puddings: | - | - |
granulated sugar: | - | - |
gravies: | - | 0.07000 |
hard candy: | - | 0.10000 |
imitation dairy: | - | - |
instant coffee / tea: | - | - |
jams / jellies: | - | - |
meat products: | - | 0.07000 |
milk products: | - | - |
nut products: | - | - |
other grains: | - | - |
poultry: | - | - |
processed fruits: | - | - |
processed vegetables: | - | - |
reconstituted vegetables: | - | - |
seasonings / flavors: | - | - |
snack foods: | - | - |
soft candy: | - | - |
soups: | - | 0.07000 |
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...
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European Food Safety Authority (EFSA) reference(s):
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Scientific Opinion on Flavouring Group Evaluation 8, Revision 3 (FGE.08Rev3): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30 View page or View pdf
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Scientific Opinion on Flavouring Group Evaluation 08, Revision 4 (FGE.08Rev4): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30 View page or View pdf
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Scientific Opinion on Flavouring Group Evaluation 08, Revision 5 (FGE.08Rev5): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30 View page or View pdf
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EPI System: View |
AIDS Citations:Search |
Cancer Citations:Search |
Toxicology Citations:Search |
EPA Substance Registry Services (TSCA):38325-25-6 |
EPA ACToR:Toxicology Data |
EPA Substance Registry Services (SRS):Registry |
Laboratory Chemical Safety Summary :61979 |
National Institute of Allergy and Infectious Diseases:Data |
2',3a-dimethylspiro[6,6a-dihydro-5H-[1,3]dithiolo[4,5-b]furan-2,3'-oxolane] |
Chemidplus:0038325256 |
References:
| 2',3a-dimethylspiro[6,6a-dihydro-5H-[1,3]dithiolo[4,5-b]furan-2,3'-oxolane] |
NIST Chemistry WebBook: | Search Inchi |
Canada Domestic Sub. List: | 38325-25-6 |
Pubchem (cid): | 61979 |
Pubchem (sid): | 135019523 |
Other Information:
Potential Blenders and core components note
For Odor |
alliaceous |
dimethyl trisulfide FL/FR |
burnt |
rum ether FL/FR |
caramellic |
strawberry furanone FL/FR |
chocolate |
2,6- dimethyl pyrazine FL/FR |
coffee |
coffee difuran FL/FR |
furfuryl mercaptan FL/FR |
2- methyl-3-,5 or 6-(furfuryl thio) pyrazine FL/FR |
fresh |
10- undecen-1-yl acetate FL/FR |
fruity |
3- mercaptohexyl acetate FL/FR |
(E)-7- methyl-3-octen-2-one FL/FR |
prunus amygdalus amara seed extract FL/FR |
(E)-2- undecenal FL/FR |
green |
(E,Z)-2,6- nonadienal FL/FR |
meaty |
meaty dithiane FL/FR |
4- methyl nonanoic acid FL/FR |
sulfurol FL/FR |
sulfuryl acetate FL/FR |
moldy |
strawberry furanone methyl ether FL/FR |
musty |
hazelnut pyrazine FL/FR |
nutty |
4,5- dimethyl-2-ethyl-3-thiazoline FL/FR |
2- ethyl-4-methyl thiazole FL/FR |
filbert heptenone FL/FR |
2,6- lutidine FL/FR |
2- methyl pyrazine FL/FR |
2- methyl-3-(methyl thio) pyrazine FL/FR |
roasted |
trigonella foenum-graecum seed oil CO2 extract FL/FR |
smoky |
2,6- dimethoxyphenol FL/FR |
pyroligneous acids FL/FR |
sulfurous |
benzothiazole FL/FR |
ethyl 3-mercaptopropionate FL/FR |
fish thiol FL/FR |
furfuryl thioacetate FL/FR |
2- mercaptopropionic acid FL/FR |
4- methyl 4-mercaptopentan-2-one 1% solution FL/FR |
methyl mercaptan FL/FR |
2-( methyl thio) phenol FL/FR |
1- phenethyl mercaptan FL/FR |
For Flavor |
No flavor group found for these |
4- acetyl-2-methyl pyrimidine FL |
gamma- aminobutyric acid FL |
amyl mercaptan FL |
1,2- butane dithiol FL |
2-(2- butyl)-4,5-dimethyl-3-thiazoline FL |
cyclopropyl (E,Z)-2,6-nonadienamide FL |
2,5- diethyl thiazole FL |
dimethyl tetrasulfide FL |
2,6- dimethyl-3-((2-methyl-3-furyl)thio)-4-heptanone FL |
bis(2,5- dimethyl-3-furyl) disulfide FL |
(Z+E)-2,5- dimethyl-3-tetrahydrofuran thiol FL |
(Z+E)-2,5- dimethyl-3-thioacetoxytetrahydrofuran FL |
2,5- dimethyl-3-thiofuroyl furan FL |
ethyl (E,Z)-2,6-nonadienamide FL |
S- ethyl 2-acetyl aminoethane thioate FL |
ethyl 3-mercaptopropionate FL/FR |
ethyl 4-(acetyl thio) butyrate FL |
(Z+E)-5- ethyl-4-methyl-2-(2-butyl) thiazoline FL |
(Z+E)-5- ethyl-4-methyl-2-(2-methyl propyl) thiazoline FL |
4- methyl 4-mercaptopentan-2-one 1% solution FL/FR |
methyl dihydrofuran thiol FL |
2- methyl thiazolidine FL |
2-( methyl thio) ethanol FL |
2- methyl-3-,5 or 6-(furfuryl thio) pyrazine FL/FR |
2- methyl-3-(methyl thio) pyrazine FL/FR |
2- methyl-3-furyl tetrasulfide FL |
3-((2- methyl-3-furyl)thio)-4-heptanone FL |
4-((2- methyl-3-furyl)thio)-5-nonanone FL |
1,9- nonane dithiol FL |
peanut dithiazine FL |
1- phenethyl mercaptan FL/FR |
1,3- propane dithiol FL |
iso propyl disulfide FL |
3- thienyl mercaptan FL |
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N-(2-(3,4- dimethoxyphenyl)ethyl)-3,4-dimethoxycinnamic acid amide FL |
3,7- dimethyl-2,6-octadien-1-yl cyclopropyl carboxamide FL |
4- mercapto-2-pentanone 1% in acetoin FL |
2- methyl-1-methyl thio-2-butene FL |
3- methyl-1,2,4-trithiane FL |
pyrrolidino-(1,2E)-4H-2,4-dimethyl-1,3,5-dithiazine FL |
1-(2- thienyl) butanone FL |
alliaceous |
alliaceous |
allyl disulfide FL |
allyl mercaptan FL |
1,3- butane dithiol FL |
cyclopentyl mercaptan FL |
dicyclohexyl disulfide FL |
dimethyl trisulfide FL/FR |
garlic oil extenders FL |
3- mercapto-2-pentanone FL |
3- tetrahydrothiophenone FL |
bacon |
bacon reaction crispy FL |
burnt |
bacon dithiazine FL |
1,6- hexane dithiol FL |
rum ether FL/FR |
caramellic |
strawberry furanone FL/FR |
chemical |
2,5- dimethyl furan FL |
cocoa |
butyraldehyde FL |
coffee |
coffee difuran FL/FR |
2- ethyl-4-methyl thiazole FL/FR |
furfuryl mercaptan FL/FR |
methyl furfuryl mercaptopropionate FL |
methyl furfuryl thiol FL |
earthy |
difurfuryl sulfide FL |
(±)-2- mercapto-5-methylheptan-4-one FL |
1,8- octane dithiol FL |
2- thienyl disulfide FL |
eggy |
iso propyl mercaptan FL |
fatty |
(E,E)-2,4- decadienal FL |
pork fat extract FL |
4- methyl nonanoic acid FL/FR |
(E)-7- methyl-3-octen-2-one FL/FR |
fruity |
2- ethyl-2,5-dihydro-4-methyl thiazole FL |
greasy |
10- undecen-1-yl acetate FL/FR |
green |
4- methyl thiazole FL |
(E,Z)-2,6- nonadienal FL/FR |
4- penten-1-yl acetate FL |
herbal |
massoia bark oil FL |
meaty |
4- allyl-2,6-dimethoxyphenol FL |
bacon flavor FL |
beef broth flavor FL |
beef flavor FL |
roast beef flavor FL |
BBQ beef flavor FL |
beef flavor base FL |
benzothiazole FL/FR |
chicken bone extract FL |
chicken extract FL |
chicken flavor FL |
grilled chicken flavor FL |
chicken key FL |
2,6- dimethyl pyrazine FL/FR |
2,6- dimethyl thiophenol FL |
2,5- dimethyl-3-furan thiol FL |
1,1- ethane dithiol 1% in ethanol 94.5% / ethyl acetate 4% FL |
ethyl 2-hydroxyethyl sulfide FL |
furfuryl 2-methyl-3-furyl disulfide FL |
4- furfuryl thio-2-pentanone FL |
ham enhancers FL |
ham flavor FL |
hot dog flavor FL |
lamb flavor FL |
liver flavor FL |
meat broth concentrates FL |
meat flavors FL |
meaty dithiane FL/FR |
meaty enhancers FL |
3- mercapto-2-butanone FL |
(R,S)-2- mercapto-3-butanol FL |
3- mercapto-3-methyl butanol FL |
2- mercaptomethyl pyrazine FL |
2- mercaptopropionic acid FL/FR |
2- methyl 3-(methyl thio) furan FL |
2-( methyl thio) phenol FL/FR |
methyl thiofuryl butanal FL |
12- methyl tridecanal FL |
bis(2- methyl-3-furyl) disulfide FL |
S-(2- methyl-3-furyl) ethane thioate FL |
2- methyl-3-tetrahydrofuran thiol FL |
2- methyl-3-thioacetoxytetrahydrofuran FL |
phenyl mercaptan FL |
grilled pork flavor FL |
pork flavor FL |
roasted pork flavor FL |
propyl 2-mercaptopropionate FL |
propyl 2-methyl-3-furyl disulfide FL |
pyrazinyl ethane thiol FL |
2- pyridinyl methane thiol FL |
rabbit flavor FL |
grilled steak flavor FL |
sulfurol FL/FR |
sulfuryl acetate FL/FR |
thialdine FL |
ortho- thiocresol FL |
ortho- thioguaiacol FL |
turkey flavor FL |
smoked turkey flavor FL |
roast turkey flavor FL |
veal flavor FL |
venison flavor FL |
medicinal |
2,6- dimethoxyphenol FL/FR |
metallic |
2,5- dihydroxy-1,4-dithiane FL |
moldy |
strawberry furanone methyl ether FL/FR |
musty |
2- ethoxythiazole FL |
hazelnut pyrazine FL/FR |
nutty |
2- acetyl-4-methyl thiazole FL |
3,5- diethyl-2-methyl pyrazine FL |
2,5- diethyl-3-methyl pyrazine FL |
4,5- dimethyl-2-ethyl-3-thiazoline FL/FR |
filbert heptenone FL/FR |
2,6- lutidine FL/FR |
2- methyl pyrazine FL/FR |
nutty thiazole FL |
prunus amygdalus amara seed extract FL/FR |
onion |
furfuryl isopropyl sulfide FL |
methionol FL |
phenolic |
2- ethyl benzene thiol FL |
popcorn |
2- propionyl-2-thiazoline FL |
roasted |
3,5- diisobutyl-1,2,4-trithiolane FL |
furfuryl thioacetate FL/FR |
hexyl mercaptan FL |
trigonella foenum-graecum seed oil CO2 extract FL/FR |
savory |
N-(2,4- dimethoxybenzyl)-N2-(2-(pyridin-2-yl)ethyl) oxalamide FL |
N-( heptan-4-yl)benzo(D)(1,3)dioxole-5-carboxamide FL |
N1-(2- methoxy-4-methyl benzyl)-N2-(2-(pyridin-2-yl)ethyl) oxalamide FL |
N1-(2- methoxy-4-methyl benzyl)-N2-2(2-(5-methyl pyridin-2-yl)ethyl) oxalamide FL |
2,4,6- triethyl tetrahydro-1,3,5-dithiazine FL |
smoky |
pyroligneous acids FL/FR |
spicy |
hot spicy beef flavor FL |
sulfurous |
2,3- butane dithiol FL |
butyl mercaptan FL |
S- ethyl thioacetate FL |
fish thiol FL/FR |
furfuryl thiopropionate FL |
methyl 2-methyl-3-furyl disulfide FL |
methyl mercaptan FL/FR |
3- methyl-2-butane thiol FL |
2- naphthyl mercaptan FL |
3- pentane thiol FL |
roasted butanol FL |
tropical |
3- mercaptohexyl acetate FL/FR |
vegetable |
tyramine FL |
waxy |
(E)-2- undecenal FL/FR |
yeasty |
faex extracts FL |
Potential Uses:
Occurrence (nature, food, other): note
Synonyms:
2',3a- | dimethyl spiro[6,6a-dihydro-5H-[1,3]dithiolo[4,5-b]furan-2,3'-oxolane] | 2',3a- | dimethylspiro[6,6a-dihydro-5H-[1,3]dithiolo[4,5-b]furan-2,3'-oxolane] | | hexahydro-2',3a-dimethylspiro(1,3-dithiolo(4,5-b)furan-2,3'(2'H)-furan) | | hexahydro-2',3a-dimethylspiro[1,3-dithiolo[4,5-b]furan-2,3'(2'H)-furan] | | hexahydro-2'3a-dimethyl spiro(1,3-dithiolo(4,5-b)furan-2,3'(2'H)-furan) | | hexahydro-2'3a-dimethylspiro(1,3-dithiolo(4,5-b)furan-2,3'(2'H)-furan) | | hexahydro-2'3a-dimethylspiro[1,3-dithiolo[4,5-b]furan-2,3'(2'H)-furan] | | spiro(1,3-dithiolo(4,5-b)furan-2,3'(2'H)-furan), hexahydro-2',3a-dimethyl- | | spiro(2,4-dithia-1-methyl-8-oxabicyclo(3.3.0)octane-3,3'-(1'-oxa-2-methyl)cyclopentane) | | spiro(2,4-dithia-1-methyl-8-oxabicyclo(3.3.0)octane-3,3'-(1'-oxa-2'-methyl)cyclopentane) | | spiro[2,4-dithia-1-methyl-8-oxabicyclo(3.3.0)octane-3,3'-(1'-oxa-2'-methyl)-cyclopentane] | | spirobeef |
Articles:
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