Chemical Properties of 1-Pentanol, 2,2-dimethyl- (CAS 2370-12-9)

1-Pentanol, 2,2-dimethyl-

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InChI
InChI=1S/C7H16O/c1-4-5-7(2,3)6-8/h8H,4-6H2,1-3H3
InChI Key
QTOMCRXZFDHJOL-UHFFFAOYSA-N
Formula
C7H16O
SMILES
CCCC(C)(C)CO
Molecular Weight1
116.20
CAS
2370-12-9
Other Names
  • 2,2-Dimethyl-1-pentanol
  • 2,2-Dimethylpentanol
  • 2,2-dimethylpentan-1-ol
  • Neoheptanol
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Physical Properties

Property Value Unit Source
Δf -125.92 kJ/mol Joback Calculated Property
Δfgas -348.79 kJ/mol Joback Calculated Property
Δfus 10.56 kJ/mol Joback Calculated Property
Δvap 46.56 kJ/mol Joback Calculated Property
log10WS [-1.52; -0.82]   Show Hide
log10WS -0.82 Aq. Sol...
log10WS -1.52 Estimat...
logPoct/wat 1.805 Crippen Calculated Property
McVol 115.360 ml/mol McGowan Calculated Property
Pc 3159.72 kPa Joback Calculated Property
Inp [854.00; 874.00]   Show Hide
Inp 854.00 NIST
Inp 863.00 NIST
Inp 874.00 NIST
Inp 874.00 NIST
Inp 868.00 NIST
Inp 874.00 NIST
I [1405.00; 1405.00]   Show Hide
I 1405.00 NIST
I 1405.00 NIST
I 1405.00 NIST
Tboil [425.90; 427.15] K Show Hide
Tboil 427.15 ± 2.00 K NIST
Tboil 425.90 ± 2.00 K NIST
Tc 618.48 K Joback Calculated Property
Tfus 231.89 K Joback Calculated Property
Vc 0.435 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [250.39; 312.34] J/mol×K [448.51; 618.48] Show Hide
Cp,gas 250.39 J/mol×K 448.51 Joback Calculated Property
Cp,gas 262.01 J/mol×K 476.84 Joback Calculated Property
Cp,gas 273.08 J/mol×K 505.17 Joback Calculated Property
Cp,gas 283.62 J/mol×K 533.50 Joback Calculated Property
Cp,gas 293.67 J/mol×K 561.82 Joback Calculated Property
Cp,gas 303.23 J/mol×K 590.15 Joback Calculated Property
Cp,gas 312.34 J/mol×K 618.48 Joback Calculated Property
η [0.0002207; 0.0985996] Pa×s [231.89; 448.51] Show Hide
η 0.0985996 Pa×s 231.89 Joback Calculated Property
η 0.0179763 Pa×s 267.99 Joback Calculated Property
η 0.0049095 Pa×s 304.10 Joback Calculated Property
η 0.0017661 Pa×s 340.20 Joback Calculated Property
η 0.0007730 Pa×s 376.30 Joback Calculated Property
η 0.0003910 Pa×s 412.41 Joback Calculated Property
η 0.0002207 Pa×s 448.51 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.64] kPa [316.62; 452.43] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.70188e+01
Coefficient B-5.29501e+03
Coefficient C-1.50000e-01
Temperature range, min.316.62
Temperature range, max.452.43
Pvap 1.33 kPa 316.62 Calculated Property
Pvap 2.85 kPa 331.71 Calculated Property
Pvap 5.72 kPa 346.80 Calculated Property
Pvap 10.82 kPa 361.89 Calculated Property
Pvap 19.44 kPa 376.98 Calculated Property
Pvap 33.39 kPa 392.07 Calculated Property
Pvap 55.11 kPa 407.16 Calculated Property
Pvap 87.74 kPa 422.25 Calculated Property
Pvap 135.28 kPa 437.34 Calculated Property
Pvap 202.64 kPa 452.43 Calculated Property

Similar Compounds

1-Hexanol, 2,2-dimethyl-. 2,2-Dimethyl heptanol. 1-Decanol, 2,2-dimethyl-. 1-Octanol, 2,2-dimethyl-. 2-Methyl-2-propyl-1-pentanol. 1,3-Propanediol, 2-methyl-2-propyl-. 1-Pentanol, 2,2,4-trimethyl-. C8H18O. 1-Hexanol, 2-ethyl-2-propyl-. 1,3-Propanediol, 2-butyl-2-ethyl-. 1-Butanol, 2,2-dimethyl-. 1-Pentanol, 2-methyl-. 3,5-dimethyl-1-hydroxymethyladamantane. 4a-methyl-1e-hydroxymethyladamantane. 1-hydroxymethyladamantane.

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

Sources

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