3-Methylheptane

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3-Methylheptane
IUPAC name 3-Methylheptane
Other names 2-Ethylhexane
Identifiers
CAS number [589-81-1]
PubChem 86182
EINECS number 209-660-6
SMILES CCCCC(C)CC
InChI 1/C8H18/c1-4-6-7-8(3)5-2/h8H,4-7H2,1-3H3
Properties
Molecular formula C8H18
Molar mass 114.23 g.mol-1
Appearance Clear liquid
Density 0.705 g.cm-3
Melting point

-121 °C, 152 K, -186 °F

Boiling point

+119 °C, 392 K, 246 °F

Hazards
Main hazards Harmful (Xn), Highly flammable (F+), Dangerous for the environment (N)
R-phrases R11, R38, R50/53, R65, R67
S-phrases S9, S16, S29, S33, S60, S61, S62
Flash point 7.2 °C
Except where noted otherwise, data are given for
materials in their standard state
(at 25 °C, 100 kPa)

Infobox disclaimer and references

3-Methylheptane is a branched alkane isomeric to octane. Its structural formula is CH3CH2CH(CH3)CH2CH2CH2CH3. It has one stereocenter.

Its refractive index is 1.398 (20 °C, D).

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