Chemical Properties of Phenol, 2-methyl- (CAS 95-48-7)

Phenol, 2-methyl-

Export as

InChI
InChI=1S/C7H8O/c1-6-4-2-3-5-7(6)8/h2-5,8H,1H3
InChI Key
QWVGKYWNOKOFNN-UHFFFAOYSA-N
Formula
C7H8O
SMILES
Cc1ccccc1O
Molecular Weight1
108.14
CAS
95-48-7
Other Names
  • 1-Hydroxy-2-methylbenzene
  • 1-Methyl-2-hydroxybenzene
  • 2-Cresol
  • 2-Hydroxytoluene
  • 2-METHYLPHENOL
  • NSC 23076
  • O-CRESYLIC ACID
  • O-HYDROXYTOLUENE
  • Orthocresol
  • Rcra waste number U052
  • o-Cresol
  • o-Kresol
  • o-Methylphenol
  • o-Methylphenylol
  • o-Oxytoluene
  • o-Toluol
  • ortho-cresol
  • ortho-hydroxytoluene
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Physical Properties

Property Value Unit Source
ω 0.4330 KDB
PAff 832.00 ± 8.00 kJ/mol NIST
BasG 800.00 ± 8.00 kJ/mol NIST
Δcliquid -3696.00 kJ/mol NIST
Δcsolid [-3697.00; -3693.30] kJ/mol Show Hide
Δcsolid -3693.60 ± 0.42 kJ/mol NIST
Δcsolid -3693.30 ± 1.00 kJ/mol NIST
Δcsolid -3697.00 kJ/mol NIST
μ 1.60 debye KDB
Δf -33.00 kJ/mol KDB
Δfgas [-128.70; -128.30] kJ/mol Show Hide
Δfgas -128.70 kJ/mol KDB
Δfgas -128.30 ± 0.88 kJ/mol NIST
Δfgas -128.60 ± 0.92 kJ/mol NIST
Δfliquid -202.00 kJ/mol NIST
Δfsolid [-204.60; -204.30] kJ/mol Show Hide
Δfsolid -204.30 kJ/mol NIST
Δfsolid -204.60 ± 0.92 kJ/mol NIST
Δfus 13.71 kJ/mol Joback Calculated Property
Δsub [73.70; 76.02] kJ/mol Show Hide
Δsub 73.70 ± 0.50 kJ/mol NIST
Δsub 76.00 kJ/mol NIST
Δsub 76.02 ± 0.75 kJ/mol NIST
Δsub 76.00 kJ/mol NIST
Δvap 44.89 kJ/mol NIST
IE [8.14; 8.93] eV Show Hide
IE 8.14 eV NIST
IE 8.24 ± 0.02 eV NIST
IE 8.93 eV NIST
IE 8.46 ± 0.06 eV NIST
IE 8.50 eV NIST
IE 8.48 eV NIST
log10WS [-0.62; -0.62]   Show Hide
log10WS -0.62 Aq. Sol...
log10WS -0.62 Estimat...
logPoct/wat 1.701 Crippen Calculated Property
McVol 91.600 ml/mol McGowan Calculated Property
NFPA Fire 2 KDB
NFPA Health 2 KDB
Pc [4170.00; 5010.00] kPa Show Hide
Pc 5010.00 kPa KDB
Pc 4170.00 ± 39.22 kPa NIST
Pc 4863.60 ± 303.98 kPa NIST
Pc 5005.46 ± 70.92 kPa NIST
Inp [170.20; 1080.00]   Show Hide
Inp 1027.00 NIST
Inp 1032.00 NIST
Inp 1032.00 NIST
Inp 1032.00 NIST
Inp 1014.30 NIST
Inp 1017.60 NIST
Inp 1007.00 NIST
Inp 1008.00 NIST
Inp 1029.00 NIST
Inp 1030.00 NIST
Inp 1030.00 NIST
Inp 1040.00 NIST
Inp 1048.00 NIST
Inp 1078.00 NIST
Inp 1039.00 NIST
Inp 1035.00 NIST
Inp 1052.00 NIST
Inp 1042.70 NIST
Inp 1071.00 NIST
Inp 1073.00 NIST
Inp 1031.10 NIST
Inp 1054.00 NIST
Inp 1080.00 NIST
Inp 1042.00 NIST
Inp 1029.70 NIST
Inp 1032.00 NIST
Inp 1042.00 NIST
Inp 1044.00 NIST
Inp 1029.00 NIST
Inp 1055.00 NIST
Inp 1068.00 NIST
Inp 1068.00 NIST
Inp 1051.80 NIST
Inp 1052.90 NIST
Inp 1052.00 NIST
Inp 1030.00 NIST
Inp 1034.00 NIST
Inp 1034.00 NIST
Inp 1054.00 NIST
Inp 1077.00 NIST
Inp 1072.00 NIST
Inp 1053.00 NIST
Inp 1054.00 NIST
Inp 1058.00 NIST
Inp 1060.00 NIST
Inp 1054.00 NIST
Inp 1030.00 NIST
Inp 1033.00 NIST
Inp 1052.00 NIST
Inp 1053.00 NIST
Inp 1027.00 NIST
Inp 1038.00 NIST
Inp 1015.00 NIST
Inp 1076.00 NIST
Inp 1076.00 NIST
Inp 1024.00 NIST
Inp 1024.00 NIST
Inp 1058.00 NIST
Inp 1051.00 NIST
Inp 1057.00 NIST
Inp 1068.00 NIST
Inp 1077.00 NIST
Inp 1053.00 NIST
Inp 1044.00 NIST
Inp 1044.00 NIST
Inp 1059.00 NIST
Inp 1030.00 NIST
Inp 1030.00 NIST
Inp 1044.00 NIST
Inp 1050.00 NIST
Inp 1037.00 NIST
Inp 1040.00 NIST
Inp 1053.00 NIST
Inp 1066.00 NIST
Inp 1079.00 NIST
Inp 1065.00 NIST
Inp 1063.00 NIST
Inp 1063.00 NIST
Inp 1030.00 NIST
Inp 1036.00 NIST
Inp 1035.00 NIST
Inp 1050.00 NIST
Inp 1055.00 NIST
Inp 1035.00 NIST
Inp Outlier 170.20 NIST
Inp Outlier 170.30 NIST
Inp Outlier 172.54 NIST
Inp Outlier 170.90 NIST
Inp Outlier 171.30 NIST
Inp Outlier 172.86 NIST
Inp Outlier 172.86 NIST
Inp Outlier 173.57 NIST
Inp Outlier 172.86 NIST
Inp 1035.00 NIST
Inp 1030.00 NIST
Inp Outlier 170.20 NIST
I [1959.00; 2053.00]   Show Hide
I 2004.00 NIST
I 1980.00 NIST
I 2014.00 NIST
I 1995.00 NIST
I 2022.00 NIST
I 2019.00 NIST
I Outlier 1959.00 NIST
I 2011.00 NIST
I 2011.00 NIST
I 2000.00 NIST
I 2000.00 NIST
I Outlier 1969.00 NIST
I 2000.00 NIST
I 2000.00 NIST
I 2019.80 NIST
I 2017.19 NIST
I 2020.19 NIST
I 2014.43 NIST
I 2033.00 NIST
I 2011.00 NIST
I 2012.00 NIST
I 2002.00 NIST
I 2000.00 NIST
I 2021.00 NIST
I 1992.00 NIST
I 1993.00 NIST
I 1992.00 NIST
I 2011.00 NIST
I 2030.00 NIST
I 2008.00 NIST
I 1995.00 NIST
I Outlier 2050.00 NIST
I 2007.00 NIST
I 2025.00 NIST
I 2025.00 NIST
I 2010.00 NIST
I 2010.00 NIST
I 1980.00 NIST
I 2030.00 NIST
I Outlier 2053.00 NIST
I 2012.00 NIST
I 1996.00 NIST
I 2000.00 NIST
I 1970.00 NIST
I 1979.00 NIST
I 1979.00 NIST
I 2004.00 NIST
I 2000.00 NIST
I 2011.00 NIST
I 2007.00 NIST
I 2010.00 NIST
I 2012.00 NIST
I 1979.00 NIST
I 2014.00 NIST
solid,1 bar 165.44 J/mol×K NIST
Tboil [460.90; 464.95] K Show Hide
Tboil 464.19 K KDB
Tboil 464.20 K NIST
Tboil 463.75 ± 2.00 K NIST
Tboil 464.10 ± 0.30 K NIST
Tboil 464.25 ± 1.00 K NIST
Tboil 464.30 ± 0.60 K NIST
Tboil 463.95 ± 1.00 K NIST
Tboil 464.25 ± 0.30 K NIST
Tboil 464.25 ± 0.35 K NIST
Tboil Outlier 460.90 ± 0.70 K NIST
Tboil 464.95 ± 1.50 K NIST
Tboil 464.65 ± 1.50 K NIST
Tboil 464.15 ± 0.50 K NIST
Tc [695.15; 697.60] K Show Hide
Tc 697.60 K KDB
Tc 697.60 ± 0.40 K NIST
Tc 697.55 ± 0.23 K NIST
Tc 695.15 ± 2.00 K NIST
Tc 695.50 ± 3.00 K NIST
Tfus [302.55; 304.60] K Show Hide
Tfus 302.90 K KDB
Tfus 304.60 K Aq. Sol...
Tfus 304.15 K Liquid ...
Tfus 304.00 ± 0.30 K NIST
Tfus 304.14 ± 0.05 K NIST
Tfus 304.05 ± 0.30 K NIST
Tfus 304.09 ± 0.05 K NIST
Tfus 304.09 ± 0.10 K NIST
Tfus 303.55 ± 0.25 K NIST
Tfus 303.50 ± 0.20 K NIST
Tfus 303.55 ± 0.50 K NIST
Tfus 303.70 ± 0.50 K NIST
Tfus 302.65 ± 0.40 K NIST
Tfus 303.45 ± 0.40 K NIST
Tfus 303.75 ± 0.20 K NIST
Tfus 303.60 ± 0.30 K NIST
Tfus 302.55 ± 0.50 K NIST
Tfus 302.90 ± 0.15 K NIST
Ttriple 304.20 ± 0.02 K NIST
Vc 0.282 m3/kmol KDB
Zc 0.2435810 KDB

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [184.27; 237.56] J/mol×K [466.86; 696.68] Show Hide
Cp,gas 184.27 J/mol×K 466.86 Joback Calculated Property
Cp,gas 195.06 J/mol×K 505.16 Joback Calculated Property
Cp,gas 204.98 J/mol×K 543.47 Joback Calculated Property
Cp,gas 214.11 J/mol×K 581.77 Joback Calculated Property
Cp,gas 222.53 J/mol×K 620.08 Joback Calculated Property
Cp,gas 230.32 J/mol×K 658.38 Joback Calculated Property
Cp,gas 237.56 J/mol×K 696.68 Joback Calculated Property
Cp,liquid [225.90; 233.60] J/mol×K [283.00; 313.00] Show Hide
Cp,liquid 225.90 J/mol×K 283.00 NIST
Cp,liquid 233.60 J/mol×K 313.00 NIST
Cp,solid 154.56 J/mol×K 298.15 NIST
η [0.0055660; 0.0132800] Pa×s [288.15; 308.15] Show Hide
η 0.0132800 Pa×s 288.15 Viscosi...
η 0.0096800 Pa×s 293.15 Viscosi...
η 0.0077600 Pa×s 298.15 Viscosi...
η 0.0065750 Pa×s 303.15 Viscosi...
η 0.0055660 Pa×s 308.15 Viscosi...
ΔfusH [13.94; 15.90] kJ/mol [303.00; 305.40] Show Hide
ΔfusH 13.94 kJ/mol 303.00 NIST
ΔfusH 14.80 kJ/mol 304.05 NIST
ΔfusH 15.90 kJ/mol 304.10 NIST
ΔfusH 14.80 kJ/mol 304.10 NIST
ΔfusH 15.82 kJ/mol 304.20 NIST
ΔfusH 15.82 kJ/mol 304.20 NIST
ΔfusH 15.82 kJ/mol 304.20 NIST
ΔfusH 14.80 kJ/mol 305.40 NIST
ΔsubH [74.80; 76.00] kJ/mol [288.00; 288.00] Show Hide
ΔsubH 74.80 kJ/mol 288.00 NIST
ΔsubH 76.00 ± 0.80 kJ/mol 288.00 NIST
ΔvapH [44.00; 58.50] kJ/mol [356.50; 573.50] Show Hide
ΔvapH 58.50 kJ/mol 356.50 NIST
ΔvapH 51.30 kJ/mol 428.00 NIST
ΔvapH 50.10 kJ/mol 434.50 NIST
ΔvapH 48.20 kJ/mol 438.50 NIST
ΔvapH 45.19 kJ/mol 464.10 KDB
ΔvapH 46.20 kJ/mol 494.50 NIST
ΔvapH 44.00 kJ/mol 573.50 NIST
n0 [1.53699; 1.54680]   [293.15; 308.15] Show Hide
n0 1.54670 293.15 Bubble ...
n0 1.54680 293.15 Excess ...
n0 1.54680 298.15 Activit...
n0 1.54670 298.15 Excess ...
n0 1.54400 298.15 Densiti...
n0 1.54099 303.15 Densiti...
n0 1.53860 308.15 Activit...
n0 1.53699 308.15 Densiti...
ρl [1001.46; 1046.00] kg/m3 [293.15; 343.15] Show Hide
ρl 1045.77 kg/m3 293.15 Experim...
ρl 1046.00 kg/m3 293.15 Bubble ...
ρl 1041.41 kg/m3 298.15 Experim...
ρl 1037.02 kg/m3 303.15 Thermod...
ρl 1037.05 kg/m3 303.15 Experim...
ρl 1036.94 kg/m3 303.15 Vapor-L...
ρl 1032.64 kg/m3 308.15 Experim...
ρl 1032.58 kg/m3 308.15 Thermod...
ρl 1032.73 kg/m3 308.15 Liquid-...
ρl 1032.73 kg/m3 308.15 Liquid-...
ρl 1028.00 kg/m3 313.00 KDB
ρl 1028.19 kg/m3 313.15 Thermod...
ρl 1028.25 kg/m3 313.15 Experim...
ρl 1023.82 kg/m3 318.15 Thermod...
ρl 1023.83 kg/m3 318.15 Experim...
ρl 1019.39 kg/m3 323.15 Experim...
ρl 1018.80 kg/m3 323.20 Liquid-...
ρl 1014.93 kg/m3 328.15 Experim...
ρl 1010.46 kg/m3 333.15 Experim...
ρl 1005.97 kg/m3 338.15 Experim...
ρl 1001.46 kg/m3 343.15 Experim...
ΔfusS [46.00; 52.00] J/mol×K [303.00; 304.20] Show Hide
ΔfusS 46.00 J/mol×K 303.00 NIST
ΔfusS 49.00 J/mol×K 304.05 NIST
ΔfusS 52.00 J/mol×K 304.20 NIST
γ 0.03 N/m 333.20 KDB

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboil 411.26 K 20.00 Measure...

Datasets

Mass density, kg/m3

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Mass density, kg/m3 - Liquid
313.20 1022.00 1027.5
313.20 2031.00 1028.1
313.20 3017.00 1028.7
313.20 4012.00 1029.2
313.20 5018.00 1029.8
313.20 6010.00 1030.4
313.20 7005.00 1030.9
313.20 8006.00 1031.5
313.20 9004.00 1032.0
313.20 10005.00 1032.6
323.16 1013.00 1018.7
323.16 2039.00 1019.3
323.16 3007.00 1019.9
323.16 4009.00 1020.5
323.16 5005.00 1021.1
323.16 6004.00 1021.7
323.16 6999.00 1022.2
323.16 8008.00 1022.8
323.16 9002.00 1023.4
323.16 10005.00 1024.0
333.10 1010.00 1009.9
333.10 2033.00 1010.5
333.10 3009.00 1011.1
333.10 4014.00 1011.8
333.10 5004.00 1012.4
333.10 5998.00 1013.0
333.10 7000.00 1013.6
333.10 8009.00 1014.2
333.10 9004.00 1014.8
333.10 10010.00 1015.4
343.06 1023.00 1000.8
343.06 2024.00 1001.6
343.06 3015.00 1002.2
343.06 4003.00 1002.9
343.06 5009.00 1003.6
343.06 6005.00 1004.2
343.06 7008.00 1004.8
343.06 8003.00 1005.5
343.06 8999.00 1006.1
343.06 10004.00 1006.7
352.99 1043.00 991.9
352.99 2000.00 992.6
352.99 3034.00 993.3
352.99 4015.00 994.0
352.99 5033.00 994.6
352.99 6007.00 995.3
352.99 7016.00 996.0
352.99 8006.00 996.7
352.99 9015.00 997.3
352.99 10014.00 998.0
Reference

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.65] kPa [352.96; 491.67] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.46886e+01
Coefficient B-3.72850e+03
Coefficient C-9.40520e+01
Temperature range, min.352.96
Temperature range, max.491.67
Pvap 1.33 kPa 352.96 Calculated Property
Pvap 2.99 kPa 368.37 Calculated Property
Pvap 6.17 kPa 383.78 Calculated Property
Pvap 11.82 kPa 399.20 Calculated Property
Pvap 21.27 kPa 414.61 Calculated Property
Pvap 36.26 kPa 430.02 Calculated Property
Pvap 59.00 kPa 445.43 Calculated Property
Pvap 92.16 kPa 460.85 Calculated Property
Pvap 138.85 kPa 476.26 Calculated Property
Pvap 202.65 kPa 491.67 Calculated Property
Pvap [0.06; 5016.43] kPa [304.19; 697.55] KDB Vap... Show Hide
Equationln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A1.36184e+02
Coefficient B-1.20881e+04
Coefficient C-1.74841e+01
Coefficient D8.51800e-06
Temperature range, min.304.19
Temperature range, max.697.55
Pvap 0.06 kPa 304.19 Calculated Property
Pvap 1.17 kPa 347.90 Calculated Property
Pvap 9.37 kPa 391.60 Calculated Property
Pvap 44.45 kPa 435.31 Calculated Property
Pvap 147.77 kPa 479.02 Calculated Property
Pvap 384.51 kPa 522.72 Calculated Property
Pvap 843.73 kPa 566.43 Calculated Property
Pvap 1644.20 kPa 610.14 Calculated Property
Pvap 2952.18 kPa 653.84 Calculated Property
Pvap 5016.43 kPa 697.55 Calculated Property

Similar Compounds

2-OH-benzyl. 2-Me-phenoxy. 1,3-benzenediol, 4-methyl-. 1,3-Benzenediol, 2-methyl-. Phenol, 2,4-dimethyl-. Phenol, 2,6-dimethyl-. 1,4-Benzenediol, 2-methyl-. Phenol, 2,5-dimethyl-. 1,2-Benzenediol, 3-methyl-. Phenol, 2,3-dimethyl-. Phenol, 3-methyl-. Phenol, 4-chloro-2-methyl-. Phenol, 2-methyl-4-iodo. 3-OH-benzyl. Salicyl-3,4,5,6-d4-aldehyde-d.

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

Mixtures

Find more mixtures with Phenol, 2-methyl-.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.

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