Chemical Properties of 2-Hexanol, 2-methyl- (CAS 625-23-0)

2-Hexanol, 2-methyl-

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InChI
InChI=1S/C7H16O/c1-4-5-6-7(2,3)8/h8H,4-6H2,1-3H3
InChI Key
KRIMXCDMVRMCTC-UHFFFAOYSA-N
Formula
C7H16O
SMILES
CCCCC(C)(C)O
Molecular Weight1
116.20
CAS
625-23-0
Other Names
  • 1,1-Dimethyl-1-pentanol
  • 2-Methyl-2-hexanoI
  • 2-Methyl-2-hexanol
  • 2-Methyl-2-hydroxyhexane
  • 2-methylhexan-2-ol
  • Butyldimethylcarbinol
  • Methyl-2 hexanol-2
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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 58.60 ± 0.40 kJ/mol NIST
log10WS [-1.08; -1.08]   Show
log10WS -1.08 Aq. Sol...
log10WS -1.08 Estimat...
logPoct/wat 1.948 Crippen Calculated Property
McVol 115.360 ml/mol McGowan Calculated Property
Pc 3159.72 kPa Joback Calculated Property
Inp [782.40; 822.00]   Show
Inp 785.70 NIST
Inp 786.10 NIST
Inp 787.00 NIST
Inp 782.40 NIST
Inp 822.00 NIST
Inp 817.00 NIST
Inp 818.00 NIST
Inp 822.00 NIST
Inp 822.00 NIST
Inp 817.00 NIST
Inp 822.00 NIST
Inp 822.00 NIST
Inp 817.00 NIST
Inp 817.00 NIST
Inp 822.00 NIST
Inp 817.00 NIST
I [1180.00; 1204.00]   Show
I 1196.00 NIST
I 1188.00 NIST
I 1180.00 NIST
I 1204.00 NIST
I 1196.00 NIST
Tboil [410.65; 416.25] K Show
Tboil 414.70 K NIST
Tboil 414.15 ± 2.00 K NIST
Tboil 415.90 ± 1.00 K NIST
Tboil 415.15 ± 1.00 K NIST
Tboil 416.25 ± 0.50 K NIST
Tboil Outlier 410.65 ± 2.00 K NIST
Tboil 415.10 ± 1.00 K NIST
Tboil 416.25 ± 0.50 K NIST
Tboil 412.15 ± 3.00 K NIST
Tboil 414.65 ± 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
T(K)
Ideal gas heat capacity (J/mol×K)
250
260
270
280
290
300
310
450
500
550
600
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
Cp,liquid [263.30; 378.10] J/mol×K [261.57; 382.70] Show
T(K)
Liquid phase heat capacity (J/mol×K)
260
280
300
320
340
360
380
300
350
Cp,liquid 263.30 J/mol×K 261.57 Calorim...
Cp,liquid 263.70 J/mol×K 261.95 Calorim...
Cp,liquid 267.20 J/mol×K 265.00 Calorim...
Cp,liquid 267.20 J/mol×K 265.00 Calorim...
Cp,liquid 273.30 J/mol×K 270.00 Calorim...
Cp,liquid 273.30 J/mol×K 270.00 Calorim...
Cp,liquid 279.80 J/mol×K 275.00 Calorim...
Cp,liquid 279.80 J/mol×K 275.00 Calorim...
Cp,liquid 286.60 J/mol×K 280.00 Calorim...
Cp,liquid 286.60 J/mol×K 280.00 Calorim...
Cp,liquid 293.90 J/mol×K 285.00 Calorim...
Cp,liquid 293.80 J/mol×K 285.00 Calorim...
Cp,liquid 301.40 J/mol×K 290.00 Calorim...
Cp,liquid 301.40 J/mol×K 290.00 Calorim...
Cp,liquid 309.00 J/mol×K 295.00 Calorim...
Cp,liquid 308.90 J/mol×K 295.00 Calorim...
Cp,liquid 316.30 J/mol×K 300.00 Calorim...
Cp,liquid 316.20 J/mol×K 300.00 Calorim...
Cp,liquid 323.60 J/mol×K 305.00 Calorim...
Cp,liquid 323.50 J/mol×K 305.00 Calorim...
Cp,liquid 330.60 J/mol×K 310.00 Calorim...
Cp,liquid 330.50 J/mol×K 310.00 Calorim...
Cp,liquid 337.30 J/mol×K 315.00 Calorim...
Cp,liquid 337.20 J/mol×K 315.00 Calorim...
Cp,liquid 343.60 J/mol×K 320.00 Calorim...
Cp,liquid 343.60 J/mol×K 320.00 Calorim...
Cp,liquid 349.40 J/mol×K 325.00 Calorim...
Cp,liquid 349.40 J/mol×K 325.00 Calorim...
Cp,liquid 354.60 J/mol×K 330.00 Calorim...
Cp,liquid 354.50 J/mol×K 330.00 Calorim...
Cp,liquid 359.10 J/mol×K 335.00 Calorim...
Cp,liquid 359.00 J/mol×K 335.00 Calorim...
Cp,liquid 363.20 J/mol×K 340.00 Calorim...
Cp,liquid 363.00 J/mol×K 340.00 Calorim...
Cp,liquid 367.20 J/mol×K 345.00 Calorim...
Cp,liquid 366.80 J/mol×K 345.00 Calorim...
Cp,liquid 370.70 J/mol×K 349.99 Calorim...
Cp,liquid 370.20 J/mol×K 350.00 Calorim...
Cp,liquid 373.20 J/mol×K 355.00 Calorim...
Cp,liquid 372.90 J/mol×K 355.00 Calorim...
Cp,liquid 375.20 J/mol×K 360.00 Calorim...
Cp,liquid 374.90 J/mol×K 360.00 Calorim...
Cp,liquid 376.70 J/mol×K 365.00 Calorim...
Cp,liquid 376.40 J/mol×K 365.00 Calorim...
Cp,liquid 377.40 J/mol×K 370.00 Calorim...
Cp,liquid 377.20 J/mol×K 370.00 Calorim...
Cp,liquid 378.00 J/mol×K 375.00 Calorim...
Cp,liquid 377.60 J/mol×K 375.00 Calorim...
Cp,liquid 378.10 J/mol×K 379.98 Calorim...
Cp,liquid 377.80 J/mol×K 380.00 Calorim...
Cp,liquid 377.70 J/mol×K 382.70 Calorim...
η [0.0002207; 0.0985996] Pa×s [231.89; 448.51] Show
T(K)
Dynamic viscosity (Pa×s)
0
0.02
0.04
0.06
0.08
0.1
300
400
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
ΔvapH 54.50 kJ/mol 363.00 NIST
Pvap [0.03; 0.52] kPa [274.40; 306.20] Show
T(K)
Vapor pressure (kPa)
0
0.1
0.2
0.3
0.4
0.5
280
290
300
Pvap 0.03 kPa 274.40 Measure...
Pvap 0.04 kPa 274.80 Measure...
Pvap 0.04 kPa 276.50 Measure...
Pvap 0.06 kPa 279.50 Measure...
Pvap 0.07 kPa 282.40 Measure...
Pvap 0.10 kPa 285.30 Measure...
Pvap 0.12 kPa 288.30 Measure...
Pvap 0.16 kPa 291.30 Measure...
Pvap 0.21 kPa 294.30 Measure...
Pvap 0.21 kPa 294.40 Measure...
Pvap 0.29 kPa 298.30 Measure...
Pvap 0.37 kPa 301.30 Measure...
Pvap 0.45 kPa 304.30 Measure...
Pvap 0.52 kPa 306.20 Measure...

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 327.20 K 2.00 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.65] kPa [319.57; 436.48] The Yaw... Show
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.56175e+01
Coefficient B-3.67654e+03
Coefficient C-7.97450e+01
Temperature range, min.319.57
Temperature range, max.436.48
T(K)
Vapor pressure (kPa)
0
50
100
150
200
350
400
Pvap 1.33 kPa 319.57 Calculated Property
Pvap 2.93 kPa 332.56 Calculated Property
Pvap 5.96 kPa 345.55 Calculated Property
Pvap 11.36 kPa 358.54 Calculated Property
Pvap 20.44 kPa 371.53 Calculated Property
Pvap 34.97 kPa 384.52 Calculated Property
Pvap 57.26 kPa 397.51 Calculated Property
Pvap 90.19 kPa 410.50 Calculated Property
Pvap 137.28 kPa 423.49 Calculated Property
Pvap 202.65 kPa 436.48 Calculated Property

Similar Compounds

2-Heptanol, 2-methyl-. 2-Dodecanol, 2-methyl-. 2-methyl-2-tetradecanol. 2-Methyl-2-nonanol. 2-Methyl-2-decanol. 2-Octanol, 2-methyl-. 2,11-Dimethyl-2,11-dodecanediol. 2,7-Dimethyl-2,7-octanediol. 5-Nonanol, 5-methyl-. 4-Octanol, 4-methyl-. 3-Heptanol, 3-methyl-. Cyclohexanol, 1-methyl-. 4-Nonanol, 4-methyl-. 2-Hexanol, 2,5-dimethyl-, (S)-. 2-Heptanol, 2,6-dimethyl-.

Find more compounds similar to 2-Hexanol, 2-methyl-.

Sources

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