4-methyl-2-(2-methyl-1-propenyl)-1,3-dioxane
1,3-dioxane, 4-methyl-2-(2-methyl-1-propenyl)-
 
Notes:
None found
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CAS Number: 55546-11-7Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 259-702-2
FDA UNII: Search
Nikkaji Web: J267.025I
XlogP3-AA: 2.10 (est)
Molecular Weight: 156.22492000
Formula: C9 H16 O2
NMR Predictor: Predict (works with chrome, Edge or firefox)
Category: fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 190.90 °C. @ 760.00 mm Hg (est)
Boiling Point: 95.00 °C. @ 11.10 mm Hg
Vapor Pressure: 0.700000 mmHg @ 25.00 °C. (est)
Flash Point: 147.00 °F. TCC ( 64.00 °C. ) (est)
logP (o/w): 1.950 (est)
Soluble in:
 water, 723.8 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor Type: floral
 
 floral  woody  chemical  fruity  berry  green  gooseberry  
Odor Description:
floral woody chemical fruity berry green gooseberry
 
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: fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
 
Recommendation for 4-methyl-2-(2-methyl-1-propenyl)-1,3-dioxane 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
EPA Substance Registry Services (TSCA): 55546-11-7
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 108345
National Institute of Allergy and Infectious Diseases: Data
 4-methyl-2-(2-methylprop-1-enyl)-1,3-dioxane
Chemidplus: 0055546117
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References:
 4-methyl-2-(2-methylprop-1-enyl)-1,3-dioxane
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 108345
Pubchem (sid): 135065934
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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-dioxane, 4-methyl-2-(2-methyl-1-propen-1-yl)-
1,3-dioxane, 4-methyl-2-(2-methyl-1-propenyl)-
4-methyl-2-(2-methylprop-1-enyl)-1,3-dioxane
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