Chemical Properties of Hexane, 3-methyl- (CAS 589-34-4)

Hexane, 3-methyl-

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InChI
InChI=1S/C7H16/c1-4-6-7(3)5-2/h7H,4-6H2,1-3H3
InChI Key
VLJXXKKOSFGPHI-UHFFFAOYSA-N
Formula
C7H16
SMILES
CCCC(C)CC
Molecular Weight1
100.20
CAS
589-34-4
Other Names
  • 2-Ethylpentane
  • 3-Methylhexane
Sources

Physical Properties

Property Value Unit Source
Δcliquid -4813.90 ± 1.20 kJ/mol NIST
Δcliquid -4813.00 ± 1.00 kJ/mol NIST
Δf 5.62 kJ/mol Joback Calculated Property
Δfgas -192.30 ± 1.30 kJ/mol NIST
Δfgas -192.90 kJ/mol NIST
Δfliquid -227.40 ± 1.30 kJ/mol NIST
Δfliquid -228.00 ± 1.00 kJ/mol NIST
Δfus 10.36 kJ/mol Joback Calculated Property
Δvap 35.16 kJ/mol NIST
Δvap 35.10 ± 0.10 kJ/mol NIST
Δvap 35.10 kJ/mol NIST
logPoct/wat 2.83 Crippen Calculated Property
Pc 2810.00 ± 40.00 kPa NIST
Pc 2813.50 ± 40.53 kPa NIST
Pc 2850.00 ± 5133.40 kPa NIST
liquid 309.60 J/mol×K NIST
Tboil [362.50; 365.30] K Show Hide
Tboil 364.20 K NIST
Tboil 365.00 K NIST
Tboil 364.70 ± 0.50 K NIST
Tboil 365.00 ± 0.30 K NIST
Tboil 365.05 ± 0.30 K NIST
Tboil 365.05 ± 0.50 K NIST
Tboil 365.03 ± 0.30 K NIST
Tboil 364.75 ± 0.50 K NIST
Tboil 364.75 ± 0.30 K NIST
Tboil 365.00 ± 0.20 K NIST
Tboil 365.15 ± 0.50 K NIST
Tboil 365.00 ± 0.20 K NIST
Tboil 365.20 ± 0.50 K NIST
Tboil 365.04 ± 0.20 K NIST
Tboil 365.00 ± 0.20 K NIST
Tboil 365.00 ± 0.15 K NIST
Tboil Outlier 363.65 ± 3.00 K NIST
Tboil 365.30 ± 1.50 K NIST
Tboil 365.15 ± 0.50 K NIST
Tboil 365.10 ± 0.06 K NIST
Tboil 364.75 ± 0.30 K NIST
Tboil 365.20 ± 0.50 K NIST
Tboil 365.11 ± 0.30 K NIST
Tboil 365.15 ± 0.50 K NIST
Tboil 364.95 ± 0.50 K NIST
Tboil 365.11 ± 0.20 K NIST
Tboil 364.75 ± 0.50 K NIST
Tboil 365.03 ± 0.20 K NIST
Tboil 364.95 ± 0.60 K NIST
Tboil 365.15 ± 0.50 K NIST
Tboil 365.15 ± 0.50 K NIST
Tboil Outlier 362.50 ± 2.00 K NIST
Tboil 364.95 ± 0.50 K NIST
Tboil 364.95 ± 0.50 K NIST
Tboil 364.95 ± 0.50 K NIST
Tboil 364.95 ± 0.50 K NIST
Tboil 364.95 ± 0.30 K NIST
Tboil Outlier 363.65 ± 0.70 K NIST
Tc [535.19; 535.55] K Show Hide
Tc 535.20 ± 0.40 K NIST
Tc 535.20 K NIST
Tc 535.19 ± 0.40 K NIST
Tc 535.55 ± 0.50 K NIST
Tfus 153.75 ± 0.50 K NIST
Vc 0.40 m3/kg-mol NIST

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 194.02 J/mol×K 359.12 Joback Calculated Property
Cp,liquid 216.70 J/mol×K 289.2 NIST
Cp,liquid 214.20 J/mol×K 289.2 NIST
η 0.00 Pa×s 359.12 Joback Calculated Property
ΔvapH [30.89; 35.10] kJ/mol [313.00; 365.00] Show Hide
Plot of Enthalpy of vaporization at a given temperature.
ΔvapH 34.20 ± 0.10 kJ/mol 313.0 NIST
ΔvapH 35.10 kJ/mol 327.5 NIST
ΔvapH 34.90 kJ/mol 329.5 NIST
ΔvapH 32.90 ± 0.10 kJ/mol 333.0 NIST
ΔvapH 31.70 ± 0.10 kJ/mol 353.0 NIST
ΔvapH 30.89 kJ/mol 365.0 NIST

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-CH2- 3
-CH3 3

Similar Compounds

(S)-(+)-3-methylhexane. Heptane, 4-methyl-. Hexane, 3-ethyl-. Cyclopentane, methyl-. Heptane, 3-methyl-. Hexane, 2,4-dimethyl-. Hexane, 3,4-dimethyl-. (S)-3-methylheptane. Pentane, 3-methyl-. Pentane, 2-methyl-. Hexane, 2-methyl-. Nonane, 5-methyl-. Heptane, 4-ethyl-. Cyclohexane, methyl-. Octane, 4-methyl-.

Find more compounds similar to Hexane, 3-methyl-.

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.