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2,5-Dimethylhexane

ALDRICH/110582 - 99%

Synonym: Diisobutyl

CAS Number: 592-13-2
Empirical Formula (Hill Notation): C8H18
Molecular Weight: 114.23
EC Number: 209-745-8
MDL Number: MFCD00008951
Linear Formula: (CH3)2CHCH2CH2CH(CH3)2
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-110582-5G 5 g
 $99.40
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assay 99%
bp 108 °C (lit.)
density 0.694 g/mL at 25 °C (lit.)
InChI 1S/C8H18/c1-7(2)5-6-8(3)4/h7-8H,5-6H2,1-4H3
InChI key UWNADWZGEHDQAB-UHFFFAOYSA-N
Quality Level 100 
refractive index n20/D 1.392 (lit.)
SMILES string CC(C)CCC(C)C
vapor pressure 1.1 psi ( 37.7 °C)
Application: 2,5-Dimethylhexane has been used to study excess entropy scaling relationships for analyzing its kinetic properties using molecular simulation.
Packaging: 5 g in glass bottle
Symbol GHS02GHS07GHS08GHS09GHS02GHS07GHS08GHS09  GHS02,GHS07,GHS08,GHS09,GHS02,GHS07,GHS08,GHS09
Signal word Danger-Danger
Hazard statements H225 - H304 - H315 - H336 - H410 - H225 - H304 - H315 - H336 - H410
Precautionary statements P210 - P261 - P273 - P210 - P273 - P301 + P310 - P331 - P301 + P310 + P331 - P302 + P352 - P501
Hazard Codes F,Xn,N
Risk Statements 11-38-50/53-65-67
Safety Statements 9-16-29-33-60-61-62
RIDADR UN3295 - class 3 - PG 3 - EHS - Hydrocarbons, liquid, n.o.s., HI
WGK Germany WGK 2
Flash Point(F) 78.8 °F - closed cup
Flash Point(C) 26 °C - closed cup
Purity 99%
bp 108 °C (lit.)
Density 0.694 g/mL at 25 °C (lit.)
Refractive Index n20/D 1.392 (lit.)
UNSPSC 12352100

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