thujic acid
dehydroperillic acid
 
Notes:
None found
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CAS Number: 499-89-8Picture of molecule3D/inchi
FDA UNII: 8P6RC5945T
Nikkaji Web: J6.185I
XlogP3-AA: 2.80 (est)
Molecular Weight: 164.20404000
Formula: C10 H12 O2
NMR Predictor: Predict (works with chrome or firefox)
Category: cosmetic ingredient for skin conditioning
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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Google Scholar: with word "odor"Search
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PubMed: Search
NCBI: Search
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Soluble in:
 water, 298.8 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: skin conditioning
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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: cosmetic ingredient for skin conditioning
Recommendation for thujic acid usage levels up to:
 not for fragrance use.
 
Recommendation for thujic acid 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 : 72620
National Institute of Allergy and Infectious Diseases: Data
 5,5-dimethylcyclohepta-1,3,6-triene-1-carboxylic acid
Chemidplus: 0000499898
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References:
 5,5-dimethylcyclohepta-1,3,6-triene-1-carboxylic acid
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 72620
Pubchem (sid): 135030273
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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
VCF-Online: VCF Volatile Compounds in Food
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
 cedar western red cedar
Search Trop  Picture
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Synonyms:
1,3,6-cycloheptatriene-1-carboxylic acid, 5,5-dimethyl- (8CI)(9CI)
 dehydroperillic acid
5,5-dimethyl-1,3,6-cycloheptatriene-1-carboxylic acid
5,5-dimethylcyclohepta-1,3,6-triene-1-carboxylic acid
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Articles:
PubMed: Cytotoxic, Antiproliferative and Apoptotic Effects of Perillyl Alcohol and Its Biotransformation Metabolite on A549 and HepG2 Cancer Cell Lines.
PubMed: Effects of leaching on fungal growth and decay of western redcedar.
PubMed: Analysis of western redcedar (Thuja plicata Donn) heartwood components by HPLC as a possible screening tool for trees with enhanced natural durability.
PubMed: Diethylamide of thujic acid: a potent repellent of Aedes aegypti.
PubMed: The x-ray structure determination of thujic acid (7,7-dimethylcycloheptatriene-3-carboxylic acid).
PubMed: Structure of thujic acid (dehydroperillic acid).
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