2,4-dimethyl-1,3-dithiolane
1,3-dithiolane, 2,4-dimethyl-
 
Notes:
None found
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CAS not foundNF0036Picture of molecule3D/inchi
Nikkaji Web: J845.863D
XlogP3-AA: 2.30 (est)
Molecular Weight: 134.26470000
Formula: C5 H10 S2
NMR Predictor: Predict (works with chrome or firefox)
Category: information only not used for fragrances or flavors
 
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 184.00 to  185.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 1.001000 mmHg @ 25.00 °C. (est)
Flash Point: 148.00 °F. TCC ( 64.40 °C. ) (est)
logP (o/w): 1.626 (est)
Soluble in:
 alcohol
 water, 621.1 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: sulfurous
 
Odor Strength: high ,
recommend smelling in a 0.10 % solution or less
 
Odor Description:
at 0.10 % in dipropylene glycol. 
sulfurous
 
 
Flavor Type: onion
 
 onion  metallic  sulfurous  
Taste Description:
onion metallic sulfurous
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
 None found
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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: information only not used for fragrances or flavors
Recommendation for 2,4-dimethyl-1,3-dithiolane usage levels up to:
 not for fragrance use.
 
Recommendation for 2,4-dimethyl-1,3-dithiolane flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
Laboratory Chemical Safety Summary : 529623
 2,4-dimethyl-1,3-dithiolane
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References:
 2,4-dimethyl-1,3-dithiolane
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 529623
Pubchem (cas): NF0036
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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
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
alliaceous
 dibutyl sulfideFL/FR
 dimethyl trisulfideFL/FR
 dipropyl disulfideFL/FR
 ferula assa-foetida gum oilFL/FR
 methyl furfuryl disulfideFL/FR
 propyl mercaptanFL/FR
citrus
 grapefruit mercaptanFL/FR
coffee
 coffee difuranFL/FR
ethereal
2-methyl-1-butanolFL/FR
fermented
 ethyl (E)-2-crotonateFL/FR
meaty
 meaty dithianeFL/FR
 dimethyl disulfideFL/FR
 dimethyl sulfideFL/FR
3,5-dimethyl-1,2-dithiolane 
1,3-dithiolane 
 ferula assa-foetida absoluteFL/FR
 methyl 3-(methyl thio) propionateFL/FR
2-methyl 5-(methyl thio) furanFL/FR
2-(methyl thio) phenolFL/FR
3-methyl-1,2-dithiolane 
 onion oilFL/FR
 onion oil dutchFL/FR
 onion oil egyptFL/FR
 onion oil mexicoFL/FR
vegetable
1-furfuryl pyrroleFL/FR
 methionalFL/FR
 
For Flavor
 
No flavor group found for these
 allyl methyl disulfideFL
 allyl methyl trisulfideFL
 allyl propyl disulfideFL
 allyl propyl sulfideFL
 allyl propyl trisulfideFL
isoamyl mercaptanFL
 amyl methyl disulfideFL
 butyl ethyl disulfideFL
 diethyl trisulfideFL
(Z+E)-2,5-dimethyl-3-tetrahydrofuran thiolFL
(Z+E)-2,5-dimethyl-3-thioacetoxytetrahydrofuranFL
 dipropyl sulfideFL
 ethyl methyl trisulfideFL
 ethyl propyl disulfideFL
 ethyl propyl trisulfideFL
2-heptane thiolFL
 heptyl mercaptanFL
4-mercapto-2-butanoneFL
 methyl butyl sulfideFL
2-(methyl thio) methyl-2-butenalFL
 prenyl mercaptanFL
1,1-propane dithiolFL
 propenyl propyl disulfideFL
isopropyl disulfideFL
2,4,6-trimethyl-1,3,5-trithianeFL
2,3,5-trithiahexaneFL
alliaceous
 allium porrum extractFL
 allyl disulfideFL
 allyl mercaptanFL
 allyl thiopropionateFL
 benzyl mercaptanFL
1,3-butane dithiolFL
 cyclopentyl mercaptanFL
 dicyclohexyl disulfideFL
 diethyl disulfideFL
 dimethyl trisulfideFL/FR
 dipropyl disulfideFL/FR
 dipropyl trisulfideFL
 ferula assa-foetida gum oilFL/FR
 leek oilFL
3-mercapto-2-methyl pentanolFL
3-mercapto-2-pentanoneFL
 methyl 3-mercaptobutanoateFL
2-methyl thioacetaldehydeFL
 onion oil extendersFL
 propyl mercaptanFL/FR
3-tetrahydrothiophenoneFL
cabbage
 methyl 2-thiofuroateFL
citrus
 grapefruit mercaptanFL/FR
coffee
 coffee difuranFL/FR
 methyl furfuryl disulfideFL/FR
corn chip
2-acetyl-2-thiazolineFL
eggy
isopropyl mercaptanFL
ethereal
2-methyl-1-butanolFL/FR
garlic
 allyl methyl sulfideFL
 garlic oleoresinFL
green
 dibutyl sulfideFL/FR
meaty
 meaty dithianeFL/FR
3-mercapto-2-butanoneFL
(R,S)-2-mercapto-3-butanolFL
2-(methyl thio) phenolFL/FR
bis(2-methyl-3-furyl) disulfideFL
ortho-thiocresolFL
musty
 ethyl (E)-2-crotonateFL/FR
2-methyl 5-(methyl thio) furanFL/FR
onion
3,5-dimethyl-1,2-dithiolane 
 methionolFL
 methyl propyl disulfideFL
 methyl propyl trisulfideFL
3-methyl-1,2-dithiolane 
 propyl thioacetateFL
roasted
 ethyl 3-(furfuryl thio) propionateFL
savory
2,4,6-triethyl tetrahydro-1,3,5-dithiazineFL
seafood
1,4-dithianeFL
sulfurous
 allyl sulfideFL
 butyl mercaptanFL
 diallyl polysulfidesFL
 diallyl tetrasulfideFL
 diallyl trisulfideFL
 dimethyl disulfideFL/FR
 dimethyl sulfideFL/FR
1,3-dithiolane 
S-ethyl thioacetateFL
 ferula assa-foetida absoluteFL/FR
 furfuryl methyl sulfideFL
 furfuryl thiopropionateFL
3-mercapto-2-methyl pentanalFL
 methyl 2-(methyl thio) butyrateFL
 methyl 2-methyl-3-furyl disulfideFL
 methyl benzyl disulfideFL
 methyl ethyl disulfideFL
1-(methyl thio)-2-butanoneFL
 methyl thiomethyl butyrateFL
2-methyl thiopheneFL
 onion oilFL/FR
 onion oil dutchFL/FR
 onion oil egyptFL/FR
 onion oil mexicoFL/FR
 onion oleoresinFL
tomato
 methionalFL/FR
vegetable
alpha-benzylidene methionalFL
1-furfuryl pyrroleFL/FR
 methyl 3-(methyl thio) propionateFL/FR
 
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Potential Uses:
 vegetableFL
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
1,3-dithiolane, 2,4-dimethyl-
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