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cyclogeraniolane
cyclohexane, 1,1,3-trimethyl-

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Name:1,1,3-trimethylcyclohexane
CAS Number: 3073-66-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:221-347-6
FDA UNII: L13QEP2K04
Nikkaji Web:J13.001J
Beilstein Number:1900451
MDL:MFCD00039462
XlogP3-AA:4.10 (est)
Molecular Weight:126.24246000
Formula:C9 H18
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:natural substances and extractives
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
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Google Patents:Search
US Patents:Search
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Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 136.00 to 137.00 °C. @ 760.00 mm Hg
Vapor Pressure:8.327000 mmHg @ 25.00 °C. (est)
Flash Point: 77.00 °F. TCC ( 25.20 °C. ) (est)
logP (o/w): 4.614 (est)
Soluble in:
 water, 1.77 mg/L @ 25 °C (exp)
 
Organoleptic Properties:
Odor Description:green sweet
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
1,1,3-TRIMETHYLCYCLOHEXANE 95%
Sigma-Aldrich
For experimental / research use only.
1,1,3-Trimethylcyclohexane purum, ≥99.0% (GC)
TCI AMERICA
For experimental / research use only.
1,1,3-Trimethylcyclohexane
 
Safety Information:
Preferred SDS: View
 
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:
intravenous-mouse LD50 18 mg/kg
U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04716

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
natural substances and extractives
Recommendation for cyclogeraniolane usage levels up to:
 not for fragrance use.
 
Recommendation for cyclogeraniolane 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 :18309
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
1,1,3-trimethylcyclohexane
Chemidplus:0003073663
RTECS:GV7650000 for cas# 3073-66-3
 
References:
 1,1,3-trimethylcyclohexane
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):18309
Pubchem (sid):134983424
 
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
Export Tariff Code:2902.19.0050
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 beef cured beef
Search PMC Picture
 chicken cured chicken
Search PMC Picture
 
Synonyms:
 cyclohexane, 1,1,3-trimethyl-
1,1,3-trimethyl cyclohexane
1,1,3-trimethylcyclohexane
 
 
Notes:
None found
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