2,2,4-trimethyl-1,3-oxathiane
1,3-oxathiane, 2,2,4-trimethyl-
 
Notes:
None found
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CAS not foundNF0210Picture of molecule3D/inchi
XlogP3-AA: 2.00 (est)
Molecular Weight: 146.25278000
Formula: C7 H14 O S
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: 191.00 °C. @ 760.00 mm Hg (est)
Boiling Point: 76.00 °C. @ 21.00 mm Hg
Vapor Pressure: 0.700000 mmHg @ 25.00 °C. (est)
Flash Point: 157.00 °F. TCC ( 69.70 °C. ) (est)
logP (o/w): 1.790 (est)
Soluble in:
 water, 548.8 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor Type: green
 
Odor Strength: high ,
recommend smelling in a 0.10 % solution or less
 
 green  woody  terpenic  fruity  tropical  green  
Odor Description:
at 0.10 % in propylene glycol. 
green, woody, terpenes, powerful fruity, tropical, green
 
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 2,2,4-trimethyl-1,3-oxathiane usage levels up to:
 not for fragrance use.
 
Recommendation for 2,2,4-trimethyl-1,3-oxathiane flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
Laboratory Chemical Safety Summary : 548235
 2,2,4-trimethyl-1,3-oxathiane
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References:
 2,2,4-trimethyl-1,3-oxathiane
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 548235
Pubchem (sid): 40361125
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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
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
1,3-oxathiane, 2,2,4-trimethyl-
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