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2,3,4-trimethyl pentane
pentane, 2,3,4-trimethyl-

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Name:2,3,4-trimethylpentane
CAS Number: 565-75-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:209-292-6
FDA UNII: WOJ1QVR6OA
Nikkaji Web:J44.097C
Beilstein Number:1696869
MDL:MFCD00008924
XlogP3-AA:3.70 (est)
Molecular Weight:114.23146000
Formula:C8 H18
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:information only not used for fragrances or flavors
 
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
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.71900 to 0.72200 @ 20.00 °C.
Pounds per Gallon - (est).: 5.990 to 6.015
Refractive Index:1.40400 to 1.40600 @ 20.00 °C.
Boiling Point: 113.50 °C. @ 760.00 mm Hg
Vapor Pressure:27.100000 mmHg @ 25.00 °C.
Flash Point: 41.00 °F. TCC ( 5.00 °C. )
Soluble in:
 water, 2.3 mg/L @ 25 °C (exp)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Santa Cruz Biotechnology
For experimental / research use only.
2,3,4-Trimethylpentane
Sigma-Aldrich: Aldrich
For experimental / research use only.
2,3,4-Trimethylpentane 98%
TCI AMERICA
For experimental / research use only.
2,3,4-Trimethylpentane >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:
information only not used for fragrances or flavors
Recommendation for 2,3,4-trimethyl pentane usage levels up to:
 not for fragrance use.
 
Recommendation for 2,3,4-trimethyl pentane flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):565-75-3
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :11269
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
2,3,4-trimethylpentane
Chemidplus:0000565753
RTECS:SA3321500 for cas# 565-75-3
 
References:
 2,3,4-trimethylpentane
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):11269
Pubchem (sid):134978641
 
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
YMDB (Yeast Metabolome Database):YMDB01344
Export Tariff Code:2901.10.5000
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:
 pentane, 2,3,4-trimethyl-
2,3,4-trimethylpentane
 

Articles:

PubMed:Measurement and estimation of rate constants for the reactions of hydroxyl radical with several alkanes and cycloalkanes.
PubMed:Effect of weight at slaughter on the volatile compounds of cooked beef from Spanish cattle breeds.
PubMed:Products and mechanism of the reaction of OH radicals with 2,3,4-trimethylpentane in the presence of NO.
PubMed:Distribution in the environment of degradative capacities for gasoline attenuation.
PubMed:Intrinsic capacities of soil microflorae for gasoline degradation.
PubMed:Lack of detectable metabolism for solubilized 2,3,4-trimethylpentane by rat kidney proximal tubules.
PubMed:In vitro toxicity of solubilized 2,3,4-trimethylpentane. I. Cytotoxicity and metabolism of TMP using primary hepatocytes.
PubMed:Identification of urinary metabolites in rats exposed to the nephrotoxic agent 2,3,4-trimethylpentane.
PubMed:The metabolism of 2,3,4-trimethylpentane in male Fischer-344 rats.
PubMed:A method for the continuous measurement of respiration and vapor uptake in rats.
PubMed:The cytotoxic effects of trimethylpentane on rat renal tissue.
 
Notes:
None found
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