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isocitronellene
5,7-dimethyl-1,6-octadiene, (R)-

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Fragrance Demo Formulas
Name:(5R)-5,7-dimethylocta-1,6-diene
CAS Number: 85006-04-8Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:285-035-1
FDA UNII: Search
Nikkaji Web:J309.579G
XlogP3-AA:4.20 (est)
Molecular Weight:138.25346000
Formula:C10 H18
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
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Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Soluble in:
 water, 1.669 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Foreverest Resources
Isocitronellene 85%
Odor: characteristic
Use: Isocitronellene is the by-product of Dihydromyrcenol in the reaction processing of isomerization.
 
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
 
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 isocitronellene flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :10964588
National Institute of Allergy and Infectious Diseases:Data
(5R)-5,7-dimethylocta-1,6-diene
Chemidplus:0085006048
 
References:
 (5R)-5,7-dimethylocta-1,6-diene
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):10964588
Pubchem (sid):135209161
Pherobase:View
 
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
Wikipedia:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
(R)-5,7-dimethyl octa-1,6-diene
5,7-dimethyl-1,6-octadiene, (R)-
(5R)-5,7-dimethylocta-1,6-diene
1,6-octadiene, 5,7-dimethyl-, (R)-
 
 
Notes:
None found
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