Octane
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For the gasoline rating system, see Octane rating, or for other uses, see Octane (disambiguation).
Thermodynamic data | |
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Identifiers | |
CAS number | |
RTECS number | RG8400000 |
SMILES | CCCCCCCC |
Properties | |
Molecular formula | C8H18 |
Molar mass | 114.2285 g/mol |
Appearance | colorless liquid |
Density | 0.703 g/ml, liquid |
Melting point | −57 °C (216 K) |
Boiling point | 125.52 °C (398.7 K) |
Solubility in water | Immiscible |
Viscosity | 0.542 cP at 20 °C |
Thermochemistry | |
Std enthalpy of formation ΔfH | −250 kJ/mol |
Std enthalpy of combustion ΔcH | −5430 kJ/mol |
Hazards | |
EU classification | Flammable (F) Harmful (Xn) Dangerous for the environment (N) |
R-phrases | R11, R38, R50/53, R65, R67 |
S-phrases | (S2), S9, S16, S29, S33, S60, S61, S62 |
Flash point | 13 °C |
Autoignition temperature | 220 °C |
Related Compounds | |
Related alkanes | Heptane 2,2,4-Trimethylpentane |
Except where noted otherwise, data are given for materials in their standard state (at 25 °C, 100 kPa) Infobox disclaimer and references |
Octane is an alkane with the chemical formula CH3(CH2)6CH3. It has 18 isomers.
One of the isomers, 2,2,4-trimethylpentane or isooctane, is of major importance, as it has been selected as the 100 point on the octane rating scale, with n-heptane as the zero point. Octane ratings are ratings used to represent the anti-knock performance of petroleum-based fuels (octane is less likely to prematurely combust under pressure than heptane), given as the percentage of 2,2,4-trimethylpentane in an 2,2,4-trimethylpentane / n-heptane mixture that would have the same performance. It is an important constituent of gasoline.
Octane has 18 isomers :
- Octane (n-octane)
- 2-Methylheptane
- 3-Methylheptane
- 4-Methylheptane
- 3-Ethylhexane
- 2,2-Dimethylhexane
- 2,3-Dimethylhexane
- 2,4-Dimethylhexane
- 2,5-Dimethylhexane
- 3,3-Dimethylhexane
- 3,4-Dimethylhexane
- 2-Methyl-3-ethylpentane
- 3-Methyl-3-ethylpentane
- 2,2,3-Trimethylpentane
- 2,2,4-Trimethylpentane (isooctane)
- 2,3,3-Trimethylpentane
- 2,3,4-Trimethylpentane
- 2,2,3,3-Tetramethylbutane