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Merck
CN

1.04715

Isooctane

Synonym(s):

2,2,4-Trimethylpentane, 2,2,4-Trimethylpentane, Isobutyltrimethylmethane, iso-Octane, Isooctane

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About This Item

Linear Formula:
(CH3)2CHCH2C(CH3)3
CAS Number:
Molecular Weight:
114.23
Beilstein/REAXYS Number:
1696876
MDL number:
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vapor density

3.9 (vs air)

vapor pressure

41 mmHg ( 21 °C)

assay

≥99.8% (GC)

form

liquid

autoignition temp.

745 °F

expl. lim.

6 %

refractive index

n20/D 1.391 (lit.)

pH

7

bp

98-99 °C (lit.)

mp

−107 °C (lit.)

density

0.692 g/mL at 25 °C (lit.)

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



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flash_point_f

10.4 °F - closed cup

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_c

-12 °C - closed cup

Regulatory Information

新产品

This item has



Certificates of Analysis (COA)

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