3,5,5-trimethyl-2-methylene hexanal
hexanal, 3,5,5-trimethyl-2-methylene-
 
Notes:
None found
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CAS Number: 22414-70-6Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 244-973-1
Nikkaji Web: J285.500C
XlogP3-AA: 3.20 (est)
Molecular Weight: 154.25266000
Formula: C10 H18 O
NMR Predictor: Predict (works with chrome 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: 204.55 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 0.262000 mmHg @ 25.00 °C. (est)
Flash Point: 142.00 °F. TCC ( 60.80 °C. ) (est)
logP (o/w): 3.328 (est)
Soluble in:
 water, 74.8 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor Type: minty
 
Odor Strength: medium ,
recommend smelling in a 1.00 % solution or less
 
 minty  camphoreous  
Odor Description:
at 1.00 % in dipropylene glycol. 
Minty camphoreous
 
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
 
Recommendation for 3,5,5-trimethyl-2-methylene hexanal flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 90773
National Institute of Allergy and Infectious Diseases: Data
 3,5,5-trimethyl-2-methylidenehexanal
Chemidplus: 0022414706
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References:
 3,5,5-trimethyl-2-methylidenehexanal
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 90773
Pubchem (sid): 135049118
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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:
 hexanal, 3,5,5-trimethyl-2-methylene-
2-methylene-3,5,5-trimethyl hexanal
3,5,5-trimethyl-2-methylenehexanal
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