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Merck
CN

650439

2,2,4-Trimethylpentane

HPLC Plus, for HPLC, GC, and residue analysis, ≥99.5%

Synonym(s):

Isooctane

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About This Item

Linear Formula:
(CH3)2CHCH2C(CH3)3
CAS Number:
Molecular Weight:
114.23
UNSPSC Code:
12190000
NACRES:
NA.21
PubChem Substance ID:
EC Number:
208-759-1
Beilstein/REAXYS Number:
1696876
MDL number:
Assay:
≥99.5%
Grade:
HPLC Plus
Technique(s):
HPLC: suitable, gas chromatography (GC): suitable
Bp:
98-99 °C (lit.)
Vapor pressure:
41 mmHg ( 21 °C)
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grade

HPLC Plus

Quality Level

vapor density

3.9 (vs air)

vapor pressure

41 mmHg ( 21 °C)

assay

≥99.5%

form

liquid

autoignition temp.

745 °F

expl. lim.

6 %

technique(s)

HPLC: suitable, gas chromatography (GC): suitable

impurities

<0.01% water, <1.0 ppb Fluorescence (quinine) at 365 nm

evapn. residue

<0.0001%

halogenated residue

<10 ng/L (as heptachlor epoxide)

refractive index

n20/D 1.391 (lit.)

bp

98-99 °C (lit.)

mp

−107 °C (lit.)

density

0.692 g/mL at 25 °C (lit.)

λ

H2O reference

UV absorption

λ: 205 nm Amax: 1.00, λ: 225 nm Amax: 0.10, λ: 254 nm Amax: 0.01

suitability

suitable for residue analysis

application(s)

food and beverages

SMILES string

CC(C)CC(C)(C)C

InChI

1S/C8H18/c1-7(2)6-8(3,4)5/h7H,6H2,1-5H3

InChI key

NHTMVDHEPJAVLT-UHFFFAOYSA-N

Application

Suitable for HPLC, spectrophotometry, environmental testing

Other Notes

Discover LiChropur reagents ideal for HPLC or LC-MS analysis


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signalword

Danger

Hazard Classifications

Aquatic Acute 1 - Aquatic Chronic 1 - Asp. Tox. 1 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Central nervous system

Storage Class

3 - Flammable liquids

wgk

WGK 2

flash_point_f

10.4 °F - closed cup

flash_point_c

-12 °C - closed cup

Regulatory Information

危险化学品

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Liquid chromatography/electrospray mass spectrometric detection of fatty acid by charge reversal derivatization with more than 4-orders of magnitude improvement in sensitivity.
Bollinger JG, et al.
Journal of Lipid Research, 55, 603-603 (2013)
Physicochemical properties of liquid mixtures. 1. Viscosity, density, surface tension and refractive index of cyclohexane+ 2, 2, 4-trimethylpentane binary liquid systems from 25 C to 50 ?C.
Gomez-Diaz D, et al.
Journal of Chemical and Engineering Data, 46(3), 720-724 (2001)
B G Short et al.
Toxicologic pathology, 14(2), 194-203 (1986-01-01)
Unleaded gasoline causes acute and chronic nephrotoxicity and renal tumors in male rats, but not female rats or mice of either sex. An active nephrotoxic component of unleaded gasoline has been identified as 2,2,4-trimethylpentane (TMP). The first objective of this



Global Trade Item Number

SKUGTIN
650439-1L04061832731728
650439-4X4L04061832731742
650439-6X1L04061837479830
650439-4L04061837479823