Chemical Properties of Hexane, 2,3-dimethyl- (CAS 584-94-1)

Hexane, 2,3-dimethyl-

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InChI
InChI=1S/C8H18/c1-5-6-8(4)7(2)3/h7-8H,5-6H2,1-4H3
InChI Key
JXPOLSKBTUYKJB-UHFFFAOYSA-N
Formula
C8H18
SMILES
CCCC(C)C(C)C
Molecular Weight1
114.23
CAS
584-94-1
Other Names
  • 2,3-DimethyIhexane
  • 2,3-Dimethylhexane
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Physical Properties

Property Value Unit Source
ω 0.3460 KDB
AP 343.750 K KDB
Δcliquid -5467.90 ± 1.40 kJ/mol NIST
Δf 17.71 kJ/mol KDB
Δc,grossH 5467.90 kJ/mol KDB
Δc,netH 5071.762 kJ/mol KDB
Δfgas [-214.10; -213.90] kJ/mol Show Hide
Δfgas -214.10 kJ/mol KDB
Δfgas -213.90 ± 1.50 kJ/mol NIST
Δfliquid -252.80 ± 1.50 kJ/mol NIST
Δfus 9.43 kJ/mol Joback Calculated Property
Δvap [38.79; 38.83] kJ/mol Show Hide
Δvap 38.83 kJ/mol NIST
Δvap 38.80 kJ/mol NIST
Δvap 38.80 ± 0.10 kJ/mol NIST
Δvap 38.79 kJ/mol NIST
log10WS -2.69 Crippen Calculated Property
logPoct/wat 3.079 Crippen Calculated Property
McVol 123.580 ml/mol McGowan Calculated Property
NFPA Fire 3 KDB
Pc [2628.20; 2630.00] kPa Show Hide
Pc 2630.00 kPa KDB
Pc 2630.00 ± 40.00 kPa NIST
Pc 2628.20 ± 40.53 kPa NIST
ρc [244.45; 244.45] kg/m3 Show Hide
ρc 244.45 ± 4.57 kg/m3 NIST
ρc 244.45 ± 4.57 kg/m3 NIST
Inp [752.00; 774.00]   Show Hide
Inp 758.60 NIST
Inp 760.20 NIST
Inp 765.60 NIST
Inp 761.00 NIST
Inp 757.00 NIST
Inp 761.40 NIST
Inp 759.60 NIST
Inp 758.00 NIST
Inp 765.60 NIST
Inp 761.00 NIST
Inp 760.30 NIST
Inp 762.20 NIST
Inp 760.10 NIST
Inp 761.50 NIST
Inp 761.00 NIST
Inp 761.00 NIST
Inp 758.00 NIST
Inp 760.00 NIST
Inp 762.00 NIST
Inp 759.70 NIST
Inp 761.10 NIST
Inp 759.60 NIST
Inp 760.20 NIST
Inp 761.00 NIST
Inp 761.80 NIST
Inp 758.00 NIST
Inp 758.00 NIST
Inp 759.00 NIST
Inp 760.00 NIST
Inp 761.00 NIST
Inp 762.00 NIST
Inp 761.40 NIST
Inp 761.40 NIST
Inp 760.00 NIST
Inp 760.00 NIST
Inp 760.00 NIST
Inp 761.00 NIST
Inp 762.00 NIST
Inp 763.00 NIST
Inp 761.00 NIST
Inp 761.20 NIST
Inp 761.20 NIST
Inp 761.00 NIST
Inp 760.00 NIST
Inp 762.00 NIST
Inp 763.66 NIST
Inp 765.12 NIST
Inp Outlier 766.66 NIST
Inp 761.34 NIST
Inp 762.45 NIST
Inp 761.00 NIST
Inp 761.00 NIST
Inp 757.00 NIST
Inp 758.00 NIST
Inp 758.00 NIST
Inp 759.00 NIST
Inp 760.00 NIST
Inp 760.30 NIST
Inp 760.40 NIST
Inp 761.00 NIST
Inp 758.00 NIST
Inp 761.00 NIST
Inp 760.00 NIST
Inp 759.00 NIST
Inp 760.00 NIST
Inp 761.00 NIST
Inp 762.00 NIST
Inp 759.50 NIST
Inp 760.50 NIST
Inp 760.00 NIST
Inp 760.00 NIST
Inp 762.00 NIST
Inp 758.00 NIST
Inp 759.00 NIST
Inp 761.00 NIST
Inp 761.00 NIST
Inp 755.00 NIST
Inp Outlier 754.00 NIST
Inp 758.00 NIST
Inp 757.90 NIST
Inp 764.00 NIST
Inp Outlier 774.00 NIST
Inp 761.10 NIST
Inp 754.96 NIST
Inp 755.35 NIST
Inp 758.30 NIST
Inp 757.90 NIST
Inp Outlier 754.10 NIST
Inp 754.50 NIST
Inp 756.00 NIST
Inp 757.00 NIST
Inp 760.50 NIST
Inp 759.00 NIST
Inp 760.10 NIST
Inp 758.65 NIST
Inp 759.59 NIST
Inp 760.14 NIST
Inp 758.63 NIST
Inp 759.55 NIST
Inp 760.10 NIST
Inp Outlier 754.00 NIST
Inp Outlier 769.99 NIST
Inp 758.00 NIST
Inp 760.00 NIST
Inp 762.00 NIST
Inp 762.00 NIST
Inp 762.00 NIST
Inp Outlier 752.00 NIST
Inp 761.00 NIST
Inp 761.00 NIST
Inp 757.00 NIST
Inp 759.00 NIST
Inp 761.00 NIST
Inp 762.00 NIST
Inp 763.00 NIST
Inp 763.00 NIST
Inp 761.00 NIST
Inp 761.00 NIST
Inp 758.00 NIST
Inp 761.00 NIST
Inp 757.00 NIST
Inp 759.00 NIST
Inp 757.00 NIST
Inp 760.00 NIST
Inp 756.00 NIST
Inp 761.00 NIST
Inp Outlier 769.99 NIST
Inp 758.60 NIST
Inp 761.40 NIST
Inp 760.30 NIST
Inp 761.00 NIST
Inp 761.10 NIST
Inp 758.00 NIST
Inp 762.00 NIST
Inp 760.00 NIST
Inp 761.20 NIST
Inp 763.66 NIST
Inp 759.00 NIST
Inp 755.00 NIST
Inp Outlier 774.00 NIST
Inp 757.90 NIST
Inp 760.50 NIST
Inp 760.14 NIST
Tboil [387.05; 389.65] K Show Hide
Tboil 388.77 K KDB
Tboil 388.80 K NIST
Tboil 388.80 K NIST
Tboil 388.79 ± 0.10 K NIST
Tboil 388.76 ± 0.20 K NIST
Tboil 388.75 ± 0.30 K NIST
Tboil 388.95 ± 0.20 K NIST
Tboil 388.65 ± 0.30 K NIST
Tboil 389.00 ± 0.30 K NIST
Tboil 388.75 ± 0.30 K NIST
Tboil 389.15 ± 1.00 K NIST
Tboil 388.65 ± 0.40 K NIST
Tboil 388.75 ± 0.01 K NIST
Tboil 388.84 ± 0.30 K NIST
Tboil 388.75 ± 0.20 K NIST
Tboil 388.40 ± 0.60 K NIST
Tboil Outlier 387.25 ± 1.00 K NIST
Tboil 388.75 ± 0.10 K NIST
Tboil 388.65 ± 0.20 K NIST
Tboil 388.65 ± 0.60 K NIST
Tboil Outlier 387.35 ± 1.00 K NIST
Tboil 388.95 ± 0.30 K NIST
Tboil 388.95 ± 0.50 K NIST
Tboil 388.95 ± 0.20 K NIST
Tboil 388.85 ± 0.50 K NIST
Tboil 388.45 ± 0.50 K NIST
Tboil 388.45 ± 0.80 K NIST
Tboil Outlier 387.05 ± 0.50 K NIST
Tboil 389.65 ± 2.00 K NIST
Tboil 389.65 ± 2.00 K NIST
Tc [563.40; 563.50] K Show Hide
Tc 563.50 K KDB
Tc 563.50 ± 0.50 K NIST
Tc 563.40 K NIST
Tc 563.42 ± 0.40 K NIST
Tfus 149.92 K Joback Calculated Property
Vc [0.468; 0.468] m3/kmol Show Hide
Vc 0.468 m3/kmol KDB
Vc 0.468 m3/kmol NIST
Zc 0.2627070 KDB

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [240.58; 299.99] J/mol×K [397.40; 522.20] Show Hide
Cp,gas 240.58 J/mol×K 397.40 NIST
Cp,gas 273.22 J/mol×K 463.70 NIST
Cp,gas 299.99 J/mol×K 522.20 NIST
η [0.0002299; 0.0231912] Pa×s [149.92; 381.56] Show Hide
η 0.0231912 Pa×s 149.92 Joback Calculated Property
η 0.0048914 Pa×s 188.53 Joback Calculated Property
η 0.0017511 Pa×s 227.13 Joback Calculated Property
η 0.0008449 Pa×s 265.74 Joback Calculated Property
η 0.0004905 Pa×s 304.35 Joback Calculated Property
η 0.0003218 Pa×s 342.95 Joback Calculated Property
η 0.0002299 Pa×s 381.56 Joback Calculated Property
ΔvapH [33.17; 41.40] kJ/mol [319.00; 388.80] Show Hide
ΔvapH 41.40 kJ/mol 319.00 NIST
ΔvapH 37.60 kJ/mol 350.00 NIST
ΔvapH 33.20 kJ/mol 388.80 KDB
ΔvapH 33.17 kJ/mol 388.80 NIST
n0 1.39880 298.15 KDB
ρl 712.00 kg/m3 293.00 KDB
γ 0.02 N/m 298.20 KDB

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.64] kPa [283.17; 415.21] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.41996e+01
Coefficient B-3.24994e+03
Coefficient C-4.95620e+01
Temperature range, min.283.17
Temperature range, max.415.21
Pvap 1.33 kPa 283.17 Calculated Property
Pvap 3.03 kPa 297.84 Calculated Property
Pvap 6.30 kPa 312.51 Calculated Property
Pvap 12.10 kPa 327.18 Calculated Property
Pvap 21.78 kPa 341.85 Calculated Property
Pvap 37.05 kPa 356.53 Calculated Property
Pvap 60.05 kPa 371.20 Calculated Property
Pvap 93.31 kPa 385.87 Calculated Property
Pvap 139.75 kPa 400.54 Calculated Property
Pvap 202.64 kPa 415.21 Calculated Property
Pvap [0.13; 2620.62] kPa [250.00; 563.40] KDB Vap... Show Hide
Equationln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A8.80002e+01
Coefficient B-7.54302e+03
Coefficient C-1.09261e+01
Coefficient D7.76601e-06
Temperature range, min.250.00
Temperature range, max.563.40
Pvap 0.13 kPa 250.00 Calculated Property
Pvap 1.48 kPa 284.82 Calculated Property
Pvap 8.87 kPa 319.64 Calculated Property
Pvap 34.93 kPa 354.47 Calculated Property
Pvap 102.92 kPa 389.29 Calculated Property
Pvap 246.86 kPa 424.11 Calculated Property
Pvap 510.27 kPa 458.93 Calculated Property
Pvap 946.38 kPa 493.76 Calculated Property
Pvap 1621.21 kPa 528.58 Calculated Property
Pvap 2620.62 kPa 563.40 Calculated Property

Similar Compounds

Hexane, 3-ethyl-2-methyl-. 3,4-Dimethylheptane, erythro. 3,4-Dimethylheptane, threo. 3,4-Dimethylheptane, (D). Heptane, 3,4-dimethyl-. Heptane, 2,3-dimethyl-. Undecane, 2,3-dimethyl-. Hexane, 2-methyl-3-(1-methylethyl)-. 2,3-Dimethyldodecane. Nonadecane, 2,3-dimethyl-. Heptadecane, 2,3-dimethyl-. 2,3-Dimethyltridecane. 4,5-dimethyloctane, racemic. Octane, 2,3-dimethyl-. Octane, 4,5-dimethyl-.

Find more compounds similar to Hexane, 2,3-dimethyl-.

Sources

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

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