3-methyl cyclohexene
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3-methylcyclohexene (Click)
CAS Number: 591-48-0 56688-75-6
ECHA EC Number: 209-717-5
MDL: MFCD00001571
XlogP3-AA: 2.80 (est)
Molecular Weight: 96.17264000
Formula: C7 H12
NMR Predictor: Predict
Category: natural substances and extractives
 
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 97.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 103.00 °C. @ 760.00 mm Hg
Vapor Pressure: 35.974998 mm/Hg @ 25.00 °C. (est)
Flash Point: 40.00 °F. TCC ( 4.44 °C. )
logP (o/w): 3.454 (est)
Shelf Life: 24.00 month(s) or longer if stored properly.
Storage: store in cool, dry place in tightly sealed containers, protected from heat and light.
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Organoleptic Properties:
Odor Type: citrus
Odor Strength: medium
Odor Description:
at 10.00 % in dipropylene glycol. 
citrus
  
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Cosmetic Information:
None found
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Suppliers:
Santa Cruz Biotechnology
3-Methyl-1-cyclohexene
For experimental / research use only.
TCI AMERICA
3-Methyl-1-cyclohexene >93.0%(GC)
For experimental / research use only.
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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: natural substances and extractives
Recommendation for 3-methyl cyclohexene usage levels up to:
 not for fragrance use.
Recommendation for 3-methyl cyclohexene flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
Chemicalize.org: Calculate predicted properties
EPA Substance Registry Services (TSCA): 591-48-0
EPA ACToR: Toxicology Data
National Institute of Allergy and Infectious Diseases: Data
 3-methylcyclohexene
DTP/NCI: 72091
Chemidplus: 0000591480
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References:
 3-methylcyclohexene
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 591-48-0
Pubchem (cid): 11573
Pubchem (sid): 134977270
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Other Information:
(IUPAC): Atomic Weights of the Elements 2009
(IUPAC): Atomic Weights of the Elements 2009 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
Export Tariff Code: 2902.19.0050
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:
 abroniaFR
 ash mountain ash berry 
 bergamotFR
 calamusFR
 cedratFL/FR
 cilantroFL/FR
 citronellaFL/FR
 citrusFR
 cologneFR
 coloniaFR
 curacaoFL/FR
 gingerFR
 grapefruitFR
 kumquatFR
 lemonFR
 lemongrassFR
 limeFR
 litsea cubeba 
 mandarin 
 melissa balm 
 nectarine 
 orange 
 orange bitter orange 
 orange mock orange 
 rhubarb 
 tangerine 
 verbena verveine 
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Natural Occurrence in: note
 found in nature
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Synonyms:
3-methyl-1-cyclohexene
3-methylcyclohexene
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click on the picture(s) below to
interact with the 3D model
Picture of molecule
Soluble in:
 alcohol
 water, 45.39 mg/L @ 25 °C (est)
Insoluble in:
 water
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