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2,2,4-trimethylpentane

Input interpretation

2, 2, 4-trimethylpentane
2, 2, 4-trimethylpentane

Chemical names and formulas

formula | (CH_3)_2CHCH_2C(CH_3)_3 Hill formula | C_8H_18 name | 2, 2, 4-trimethylpentane alternate names | isobutyltrimethylmethane | isooctane | pentane, 2, 2, 4-trimethyl- mass fractions | C (carbon) 84.1% | H (hydrogen) 15.9%
formula | (CH_3)_2CHCH_2C(CH_3)_3 Hill formula | C_8H_18 name | 2, 2, 4-trimethylpentane alternate names | isobutyltrimethylmethane | isooctane | pentane, 2, 2, 4-trimethyl- mass fractions | C (carbon) 84.1% | H (hydrogen) 15.9%

Lewis structure

Draw the Lewis structure of 2, 2, 4-trimethylpentane. Start by drawing the overall structure of the molecule:  Count the total valence electrons of the carbon (n_C, val = 4) and hydrogen (n_H, val = 1) atoms: 8 n_C, val + 18 n_H, val = 50 Calculate the number of electrons needed to completely fill the valence shells for carbon (n_C, full = 8) and hydrogen (n_H, full = 2): 8 n_C, full + 18 n_H, full = 100 Subtracting these two numbers shows that 100 - 50 = 50 bonding electrons are needed. Each bond has two electrons, so the above diagram has all the necessary bonds. There are 25 bonds and hence 50 bonding electrons in the diagram. Lastly, fill in the remaining unbonded electrons on each atom. In total, there remain 50 - 50 = 0 electrons left to draw and the diagram is complete: Answer: |   |
Draw the Lewis structure of 2, 2, 4-trimethylpentane. Start by drawing the overall structure of the molecule: Count the total valence electrons of the carbon (n_C, val = 4) and hydrogen (n_H, val = 1) atoms: 8 n_C, val + 18 n_H, val = 50 Calculate the number of electrons needed to completely fill the valence shells for carbon (n_C, full = 8) and hydrogen (n_H, full = 2): 8 n_C, full + 18 n_H, full = 100 Subtracting these two numbers shows that 100 - 50 = 50 bonding electrons are needed. Each bond has two electrons, so the above diagram has all the necessary bonds. There are 25 bonds and hence 50 bonding electrons in the diagram. Lastly, fill in the remaining unbonded electrons on each atom. In total, there remain 50 - 50 = 0 electrons left to draw and the diagram is complete: Answer: | |

3D structure

3D structure
3D structure

Basic properties

molar mass | 114.23 g/mol phase | liquid (at STP) melting point | -107 °C boiling point | 98.5 °C density | 0.692 g/cm^3 solubility in water | insoluble
molar mass | 114.23 g/mol phase | liquid (at STP) melting point | -107 °C boiling point | 98.5 °C density | 0.692 g/cm^3 solubility in water | insoluble

Units

Liquid properties (at STP)

density | 0.692 g/cm^3 vapor pressure | 40.99 mmHg dynamic viscosity | 4.8×10^-4 Pa s (at 25 °C) surface tension | 0.0162 N/m refractive index | 1.391
density | 0.692 g/cm^3 vapor pressure | 40.99 mmHg dynamic viscosity | 4.8×10^-4 Pa s (at 25 °C) surface tension | 0.0162 N/m refractive index | 1.391

Units

Thermodynamic properties

specific heat capacity c_p | liquid | 2.093 J/(g K) molar heat capacity c_p | liquid | 239.1 J/(mol K) specific heat of formation Δ_fH° | gas | -1.961 kJ/g molar heat of formation Δ_fH° | gas | -224 kJ/mol molar heat of vaporization | 35.15 kJ/mol |  specific heat of vaporization | 0.3077 kJ/g |  molar heat of fusion | 9.2 kJ/mol |  specific heat of fusion | 0.081 kJ/g |  critical temperature | 544 K |  critical pressure | 2.57 MPa |  (at STP)
specific heat capacity c_p | liquid | 2.093 J/(g K) molar heat capacity c_p | liquid | 239.1 J/(mol K) specific heat of formation Δ_fH° | gas | -1.961 kJ/g molar heat of formation Δ_fH° | gas | -224 kJ/mol molar heat of vaporization | 35.15 kJ/mol | specific heat of vaporization | 0.3077 kJ/g | molar heat of fusion | 9.2 kJ/mol | specific heat of fusion | 0.081 kJ/g | critical temperature | 544 K | critical pressure | 2.57 MPa | (at STP)

Chemical identifiers

CAS number | 540-84-1 Beilstein number | 1696876 PubChem CID number | 10907 PubChem SID number | 24855659 SMILES identifier | CC(C)CC(C)(C)C InChI identifier | InChI=1/C8H18/c1-7(2)6-8(3, 4)5/h7H, 6H2, 1-5H3 RTECS number | SA3320000 MDL number | MFCD00008943
CAS number | 540-84-1 Beilstein number | 1696876 PubChem CID number | 10907 PubChem SID number | 24855659 SMILES identifier | CC(C)CC(C)(C)C InChI identifier | InChI=1/C8H18/c1-7(2)6-8(3, 4)5/h7H, 6H2, 1-5H3 RTECS number | SA3320000 MDL number | MFCD00008943

NFPA label

NFPA label
NFPA label
NFPA health rating | 1 NFPA fire rating | 3 NFPA reactivity rating | 0
NFPA health rating | 1 NFPA fire rating | 3 NFPA reactivity rating | 0

Safety properties

flash point | -12 °C autoignition point | 410 °C lower explosive limit | 1% (concentration in air) upper explosive limit | 6% (concentration in air)
flash point | -12 °C autoignition point | 410 °C lower explosive limit | 1% (concentration in air) upper explosive limit | 6% (concentration in air)
DOT hazard class | 3 DOT numbers | 1262
DOT hazard class | 3 DOT numbers | 1262

Toxicity properties

RTECS classes | mutagen
RTECS classes | mutagen