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2,5-dimethyl-2,5-hexane diol
2,5-hexanediol, 2,5-dimethyl-

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Name:2,5-dimethylhexane-2,5-diol
CAS Number: 110-03-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:203-731-5
FDA UNII:3PNB2S8721
Nikkaji Web:J126.489C
Beilstein Number:1361437
MDL:MFCD00004473
XlogP3-AA:0.80 (est)
Molecular Weight:146.22986000
Formula:C8 H18 O2
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome or firefox)
Category:pharmaceuticals / chemical synthisis
 
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:
Appearance:white to pale yellow crystalline solid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.89800 @ 20.00 °C.
Melting Point: 92.00 °C. @ 760.00 mm Hg
Boiling Point: 214.00 to 215.00 °C. @ 760.00 mm Hg
Flash Point: 260.00 °F. TCC ( 126.67 °C. )
logP (o/w): 0.370 (est)
Soluble in:
 acetone
 alcohol
 cyclohexanone
 ethyl acetate
 water, 3929 mg/L @ 25 °C (est)
Insoluble in:
 benzene
 kerosene
 soyabean oil
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BASF
2,5-Dimethyl-2,5-hexanediol
BOC Sciences
For experimental / research use only.
2,5-Dimethyl-2,5-hexanediol 98%
EMD Millipore
For experimental / research use only.
2,5-Dimethyl-2,5-hexanediol
Santa Cruz Biotechnology
For experimental / research use only.
2,5-Dimethyl-2,5-hexanediol
Sigma-Aldrich: Aldrich
For experimental / research use only.
2,5-Dimethyl-2,5-hexanediol 97%
TCI AMERICA
For experimental / research use only.
2,5-Dimethyl-2,5-hexanediol >99.0%(GC)
 
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
 
Safety in Use Information:
Category:
pharmaceuticals / chemical synthisis
Recommendation for 2,5-dimethyl-2,5-hexane diol usage levels up to:
 not for fragrance use.
 
Recommendation for 2,5-dimethyl-2,5-hexane diol flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):110-03-2
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :8031
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
2,5-dimethylhexane-2,5-diol
Chemidplus:0000110032
 
References:
 2,5-dimethylhexane-2,5-diol
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:110-03-2
Pubchem (cid):8031
Pubchem (sid):134974019
 
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
CHEMBL:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2905.39.9000
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
2,5-dihydroxy-2,5-dimethylhexane
2,5-dimethyl hexane-2,5-diol
2,5-dimethyl-2,5-hexandiol
2,5-dimethyl-2,5-hexanediol
2,5-dimethylhexane-2,5-diol
2,5-hexanediol, 2,5-dimethyl-
1,1,4,4-tetramethyl-1,4-butanediol
 
 
Notes:
None found
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