thexyl alcohol
butan-2-ol, 2,3-dimethyl-
 
Notes:
None found
  • BOC Sciences
    • BOC Sciences
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      Product(s):
      594-60-5 2,3-Dimethyl-2-butanol
       
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CAS Number: 594-60-5Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 209-847-2
Nikkaji Web: J2.706E
MDL: MFCD00004463
XlogP3-AA: 1.50 (est)
Molecular Weight: 102.17678000
Formula: C6 H14 O
NMR Predictor: Predict (works with chrome or firefox)
Category: natural substances and extractives
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar: Search
Google Books: Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Google Patents: Search
US Patents: Search
EU Patents: Search
Pubchem Patents: Search
PubMed: Search
NCBI: Search
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.82300 @  25.00 °C.
Refractive Index: 1.41700 @  20.00 °C.
Boiling Point: 118.00 to  119.00 °C. @ 760.00 mm Hg
Vapor Pressure: 8.470000 mmHg @ 25.00 °C. (est)
Flash Point: 85.00 °F. TCC ( 29.44 °C. )
logP (o/w): 1.447 (est)
Soluble in:
 alcohol
 water, 43500 mg/L @ 25 °C (exp)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
BOC Sciences
For experimental / research use only.
2,3-Dimethyl-2-butanol
Santa Cruz Biotechnology
For experimental / research use only.
2,3-Dimethyl-2-butanol
Sigma-Aldrich: Aldrich
For experimental / research use only.
2,3-Dimethyl-2-butanol 98%
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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:
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 thexyl alcohol usage levels up to:
 not for fragrance use.
 
Recommendation for thexyl alcohol 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 : 11670
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 3
 2,3-dimethylbutan-2-ol
Chemidplus: 0000594605
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References:
 2,3-dimethylbutan-2-ol
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 594-60-5
Pubchem (cid): 11670
Pubchem (sid): 134978459
Pherobase: View
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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
Export Tariff Code: 2905.19.0020
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
 pineapple fruit
Search Trop  Picture
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Synonyms:
 butan-2-ol, 2,3-dimethyl-
2-butanol, 2,3-dimethyl-
2,3-dimethyl butan-2-ol
2,3-dimethyl-2-butanol
2,3-dimethylbutan-2-ol
isopropyl dimethyl carbinol
isopropyldimethylcarbinol
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Articles:
PubMed: Titania-catalyzed radiofluorination of tosylated precursors in highly aqueous medium.
PubMed: Efficient radiosynthesis of 3'-deoxy-3'-18F-fluorothymidine using electrowetting-on-dielectric digital microfluidic chip.
PubMed: Kinetic study of the gas phase reactions of a series of alcohols with the NO3 radical.
PubMed: Aging mechanism of soman inhibited acetylcholinesterase.
PubMed: Relative and absolute kinetic studies of 2-butanol and related alcohols with tropospheric Cl atoms.
PubMed: Atmospheric degradation of 2-butanol, 2-methyl-2-butanol, and 2,3-dimethyl-2-butanol: OH kinetics and UV absorption cross sections.
PubMed: Photoionization of 2,3-dimethyl-2-butanol (thexyl alcohol): interaction between the charged and expelled fragments.
PubMed: Small molecular products of dealkylation in soman-inhibited electric eel acetylcholinesterase.
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