Chemical Properties of 1-Pentanol, 2-methyl- (CAS 105-30-6)

1-Pentanol, 2-methyl-

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InChI
InChI=1S/C6H14O/c1-3-4-6(2)5-7/h6-7H,3-5H2,1-2H3
InChI Key
PFNHSEQQEPMLNI-UHFFFAOYSA-N
Formula
C6H14O
SMILES
CCCC(C)CO
Molecular Weight1
102.17
CAS
105-30-6
Other Names
  • 2-Methyl-1-pentanol
  • 2-Methyl-2-propylethanol
  • 2-Methylpentanol
  • 2-Methylpentanol-1
  • 2-methylpentan-1-ol
  • 2-methylpentyl alcohol
  • AMYL METHYL ALCOHOL
  • ISOPROPYL DIMETHYL CARBINOL
  • Isohexyl alcohol
  • M.I.B.C.
  • Methyl-2 pentanol-1
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Physical Properties

Property Value Unit Source
Δf -139.62 kJ/mol Joback Calculated Property
Δfgas -324.68 kJ/mol Joback Calculated Property
Δfus 11.86 kJ/mol Joback Calculated Property
Δvap 59.40 ± 0.30 kJ/mol NIST
log10WS [-1.11; -1.11]   Show Hide
log10WS -1.11 Aq. Sol...
log10WS -1.11 Estimat...
logPoct/wat 1.415 Crippen Calculated Property
McVol 101.270 ml/mol McGowan Calculated Property
Pc [3450.00; 3450.00] kPa Show Hide
Pc 3450.00 kPa KDB
Pc 3450.00 ± 20.00 kPa NIST
Pc 3450.00 ± 50.00 kPa NIST
Inp [132.61; 846.00]   Show Hide
Inp 836.20 NIST
Inp 837.50 NIST
Inp 820.00 NIST
Inp 798.00 NIST
Inp 803.00 NIST
Inp 824.00 NIST
Inp 822.00 NIST
Inp 820.00 NIST
Inp 831.00 NIST
Inp 822.00 NIST
Inp 826.00 NIST
Inp 827.00 NIST
Inp 838.00 NIST
Inp 843.00 NIST
Inp 837.00 NIST
Inp 846.00 NIST
Inp 824.00 NIST
Inp 818.00 NIST
Inp 837.00 NIST
Inp 824.00 NIST
Inp 818.00 NIST
Inp 836.00 NIST
Inp 824.00 NIST
Inp 824.00 NIST
Inp 837.00 NIST
Inp 813.00 NIST
Inp 818.00 NIST
Inp Outlier 132.61 NIST
I [1247.00; 1337.00]   Show Hide
I 1312.00 NIST
I 1320.00 NIST
I 1293.00 NIST
I 1288.00 NIST
I 1284.00 NIST
I 1297.00 NIST
I 1268.00 NIST
I 1337.00 NIST
I 1247.00 NIST
Tboil 428.42 K Joback Calculated Property
Tc [604.40; 604.40] K Show Hide
Tc 604.40 K KDB
Tc 604.40 ± 0.50 K NIST
Tc 604.40 ± 0.70 K NIST
Tfus 203.20 K Joback Calculated Property
Vc 0.385 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [207.74; 261.25] J/mol×K [428.42; 592.97] Show Hide
Cp,gas 207.74 J/mol×K 428.42 Joback Calculated Property
Cp,gas 217.54 J/mol×K 455.85 Joback Calculated Property
Cp,gas 226.97 J/mol×K 483.27 Joback Calculated Property
Cp,gas 236.05 J/mol×K 510.70 Joback Calculated Property
Cp,gas 244.78 J/mol×K 538.12 Joback Calculated Property
Cp,gas 253.18 J/mol×K 565.55 Joback Calculated Property
Cp,gas 261.25 J/mol×K 592.97 Joback Calculated Property
Cp,liquid [247.63; 249.21] J/mol×K [298.15; 298.15] Show Hide
Cp,liquid 249.21 J/mol×K 298.15 NIST
Cp,liquid 247.63 J/mol×K 298.15 NIST
Cp,liquid 248.40 J/mol×K 298.15 NIST
η [0.0022500; 0.0045500] Pa×s [303.15; 323.15] Show Hide
η 0.0045500 Pa×s 303.15 Density...
η 0.0031800 Pa×s 313.15 Density...
η 0.0022500 Pa×s 323.15 Density...
ΔvapH [49.30; 64.90] kJ/mol [277.50; 395.00] Show Hide
ΔvapH 64.90 kJ/mol 277.50 NIST
ΔvapH 57.40 ± 0.20 kJ/mol 328.00 NIST
ΔvapH 55.70 ± 0.20 kJ/mol 343.00 NIST
ΔvapH 50.20 kJ/mol 355.50 NIST
ΔvapH 53.90 ± 0.20 kJ/mol 358.00 NIST
ΔvapH 54.20 kJ/mol 360.50 NIST
ΔvapH 52.70 ± 0.20 kJ/mol 368.00 NIST
ΔvapH 49.30 kJ/mol 395.00 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.64] kPa [320.82; 444.44] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.61826e+01
Coefficient B-4.25182e+03
Coefficient C-5.33290e+01
Temperature range, min.320.82
Temperature range, max.444.44
Pvap 1.33 kPa 320.82 Calculated Property
Pvap 2.90 kPa 334.56 Calculated Property
Pvap 5.86 kPa 348.29 Calculated Property
Pvap 11.12 kPa 362.03 Calculated Property
Pvap 20.00 kPa 375.76 Calculated Property
Pvap 34.28 kPa 389.50 Calculated Property
Pvap 56.33 kPa 403.23 Calculated Property
Pvap 89.14 kPa 416.97 Calculated Property
Pvap 136.42 kPa 430.70 Calculated Property
Pvap 202.64 kPa 444.44 Calculated Property
Pvap [1.42e-04; 3366.14] kPa [223.00; 582.00] KDB Vap... Show Hide
Equationln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A5.09496e+01
Coefficient B-7.82259e+03
Coefficient C-4.56500e+00
Coefficient D-9.57195e-07
Temperature range, min.223.00
Temperature range, max.582.00
Pvap 1.42e-04 kPa 223.00 Calculated Property
Pvap 0.01 kPa 262.89 Calculated Property
Pvap 0.35 kPa 302.78 Calculated Property
Pvap 3.91 kPa 342.67 Calculated Property
Pvap 24.87 kPa 382.56 Calculated Property
Pvap 105.75 kPa 422.44 Calculated Property
Pvap 334.62 kPa 462.33 Calculated Property
Pvap 847.46 kPa 502.22 Calculated Property
Pvap 1807.26 kPa 542.11 Calculated Property
Pvap 3366.14 kPa 582.00 Calculated Property

Similar Compounds

2-methyl-1-hexanol. 2,4-dimethyl-1-pentanol. 1-Heptanol, 2-methyl. 2-methyl-1-heptanol. 1-Decanol, 2-methyl-. ISODECANOL. 1-Octanol, 2-methyl-. 1-Hexadecanol, 2-methyl-. 1-Dodecanol, 2-methyl. 2-methyl-1-pentadecanol. 2-Methyl-1-undecanol. 1-Octanol, 2,7-dimethyl-. 1-Pentanol, 2-ethyl-. 2-Propyl-1-pentanol. 1-Pentanol, 2-ethyl-4-methyl-.

Find more compounds similar to 1-Pentanol, 2-methyl-.

Mixtures

Sources

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