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2,3,4-Trimethylpentane Structure

2,3,4-Trimethylpentane

Chemical Properties

Melting point -110 °C (lit.)
Boiling point 113-114 °C (lit.)
Density  0.719 g/mL at 25 °C (lit.)
vapor pressure  27.0 at 25 °C (Wilhoit and Zwolinski, 1971)
refractive index  n20/D 1.404(lit.)
Flash point 5°C
solubility  Soluble in acetone, alcohol, benzene, chloroform, ether (Weast, 1986); miscible with many aliphatic hydrocarbons
pka >14 (Schwarzenbach et al., 1993)
form  clear liquid
color  Colorless to Almost colorless
Water Solubility  (mg/kg):
1.36 at 25 °C (shake flask-GLC, Price, 1976)
2.34 at 0 °C, 2.30 at 25 °C (shake flask-GC, Polak and Lu, 1973)
Thermal Conductivity 0.1035 W/(m·K) at 25 ℃
Specific Heat Capacity Cp(liquid): 2.16 J/(g·K), at 25℃
BRN  1696869
Henry's Law Constant 1.89 at 25 °C (Mackay and Shiu, 1981)
Exposure limits ACGIH TLV: TWA for all isomers 300 ppm (adopted).
InChI 1S/C8H18/c1-6(2)8(5)7(3)4/h6-8H,1-5H3
InChIKey RLPGDEORIPLBNF-UHFFFAOYSA-N
SMILES CC(C)C(C)C(C)C
CAS DataBase Reference 565-75-3(CAS DataBase Reference)
EPA Substance Registry System 2,3,4-Trimethylpentane (565-75-3)

Safety Information

Hazard Codes  F,Xn,N
Risk Statements  11-38-50/53-65-67
Safety Statements  9-16-29-33-60-61-62
RIDADR  UN 3295 3/PG 2
WGK Germany  3
RTECS  SA3321500
TSCA  TSCA listed
HS Code  2901.10.5000
HazardClass  3
PackingGroup  II
Storage Class 3 - Flammable liquids
Hazard Classifications Aquatic Acute 1
Aquatic Chronic 1
Asp. Tox. 1
Flam. Liq. 2
Skin Irrit. 2
STOT SE 3

MSDS

Usage And Synthesis

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