Chemical Properties of 1-Propanone, 1-phenyl- (CAS 93-55-0)

1-Propanone, 1-phenyl-

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InChI
InChI=1S/C9H10O/c1-2-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChI Key
KRIOVPPHQSLHCZ-UHFFFAOYSA-N
Formula
C9H10O
SMILES
CCC(=O)c1ccccc1
Molecular Weight1
134.18
CAS
93-55-0
Other Names
  • 1-Phenyl-1-propanone
  • 1-phenylpropanone
  • Ethyl phenyl ketone
  • Ketone, ethyl phenyl
  • NSC 16937
  • Phenyl ethyl ketone
  • Propionylbenzene
  • Propiophenone
  • USAF EK-1235
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Contents

  1. Physical Properties
  2. Temperature Dependent Properties
  3. Datasets
  4. Correlations
  5. Similar Compounds
  6. Mixtures
  7. Sources

Physical Properties

Property Value Unit Source
PAff 867.40 kJ/mol NIST
BasG 835.60 kJ/mol NIST
Δcliquid -4803.70 ± 1.00 kJ/mol NIST
EA 0.35 ± 0.00 eV NIST
Δf 8.39 kJ/mol Joback Calculated Property
Δfgas -105.14 kJ/mol Joback Calculated Property
Δfliquid -167.20 ± 1.30 kJ/mol NIST
Δfus 14.71 kJ/mol Joback Calculated Property
Δvap 44.65 kJ/mol Joback Calculated Property
IE [9.16; 9.27] eV Show Hide
IE 9.16 eV NIST
IE 9.27 ± 0.05 eV NIST
log10WS -1.83 Aq. Sol...
logPoct/wat 2.279 Crippen Calculated Property
McVol 115.480 ml/mol McGowan Calculated Property
Pc 3509.58 kPa Joback Calculated Property
Inp [1140.00; 1188.60]   Show Hide
Inp 1164.00 NIST
Inp 1179.00 NIST
Inp 1165.30 NIST
Inp 1172.80 NIST
Inp 1188.60 NIST
Inp 1180.30 NIST
Inp 1183.00 NIST
Inp 1174.00 NIST
Inp 1176.00 NIST
Inp 1176.00 NIST
Inp 1176.00 NIST
Inp 1176.00 NIST
Inp 1176.00 NIST
Inp 1176.00 NIST
Inp 1176.00 NIST
Inp 1177.00 NIST
Inp 1178.00 NIST
Inp 1179.00 NIST
Inp 1181.00 NIST
Inp 1164.00 NIST
Inp 1164.00 NIST
Inp 1164.00 NIST
Inp Outlier 1140.00 NIST
Inp Outlier 1144.00 NIST
Inp 1164.00 NIST
Inp 1179.00 NIST
Inp 1183.00 NIST
I [1682.00; 1744.00]   Show Hide
I 1734.00 NIST
I 1682.00 NIST
I 1744.00 NIST
I 1696.00 NIST
I 1737.00 NIST
I 1712.00 NIST
I 1734.00 NIST
Tboil [471.15; 490.90] K Show Hide
Tboil 490.70 K NIST
Tboil 481.15 ± 10.00 K NIST
Tboil 471.15 ± 10.00 K NIST
Tboil 490.85 ± 1.00 K NIST
Tboil 490.90 ± 0.50 K NIST
Tboil 489.15 ± 2.00 K NIST
Tc 704.23 K Joback Calculated Property
Tfus [288.15; 291.76] K Show Hide
Tfus 291.55 K Aq. Sol...
Tfus 291.76 ± 0.05 K NIST
Tfus 288.15 ± 1.50 K NIST
Vc 0.438 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [233.47; 299.72] J/mol×K [485.87; 704.23] Show Hide
Cp,gas 233.47 J/mol×K 485.87 Joback Calculated Property
Cp,gas 246.41 J/mol×K 522.26 Joback Calculated Property
Cp,gas 258.54 J/mol×K 558.66 Joback Calculated Property
Cp,gas 269.91 J/mol×K 595.05 Joback Calculated Property
Cp,gas 280.54 J/mol×K 631.45 Joback Calculated Property
Cp,gas 290.46 J/mol×K 667.84 Joback Calculated Property
Cp,gas 299.72 J/mol×K 704.23 Joback Calculated Property
η [0.0002719; 0.0030402] Pa×s [267.54; 485.87] Show Hide
η 0.0030402 Pa×s 267.54 Joback Calculated Property
η 0.0015978 Pa×s 303.93 Joback Calculated Property
η 0.0009636 Pa×s 340.32 Joback Calculated Property
η 0.0006407 Pa×s 376.71 Joback Calculated Property
η 0.0004578 Pa×s 413.09 Joback Calculated Property
η 0.0003454 Pa×s 449.48 Joback Calculated Property
η 0.0002719 Pa×s 485.87 Joback Calculated Property
ΔvapH [44.40; 52.10] kJ/mol [422.50; 505.50] Show Hide
ΔvapH 44.40 kJ/mol 422.50 NIST
ΔvapH 52.10 kJ/mol 505.50 NIST
n0 [1.52450; 1.52450]   [298.15; 298.15] Show Hide
n0 1.52450 298.15 Excess ...
n0 1.52450 298.15 Excess ...
ρl 1009.20 kg/m3 298.15 Ultraso...
csound,fluid 1432.00 m/s 308.15 Ultraso...

Datasets

  1. Viscosity, Pa*s (1)
  2. Mass density, kg/m3 (1)

Viscosity, Pa*s

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Viscosity, Pa*s - Liquid
308.15 101.30 0.0015
Reference

Mass density, kg/m3

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Mass density, kg/m3 - Liquid
298.15 100.00 1005.3
298.15 2130.00 1006.4
298.15 4150.00 1007.5
298.15 6180.00 1008.7
298.15 8210.00 1009.8
298.15 10230.00 1010.9
298.15 11250.00 1011.5
298.15 12260.00 1012.1
298.15 14290.00 1013.2
298.15 16310.00 1014.3
298.15 18340.00 1015.3
298.15 20370.00 1016.4
298.15 22390.00 1017.5
298.15 24420.00 1018.5
298.15 26450.00 1019.5
298.15 28470.00 1020.5
298.15 29490.00 1021.0
298.15 30500.00 1021.6
298.15 32530.00 1022.5
298.15 34550.00 1023.5
298.15 36580.00 1024.5
298.15 38600.00 1025.5
298.15 39620.00 1025.9
308.15 100.00 996.8
308.15 2130.00 998.0
308.15 4150.00 999.2
308.15 6180.00 1000.4
308.15 8210.00 1001.6
308.15 10230.00 1002.8
308.15 11250.00 1003.4
308.15 12260.00 1003.9
308.15 14290.00 1005.1
308.15 16310.00 1006.2
308.15 18340.00 1007.3
308.15 20370.00 1008.4
308.15 22390.00 1009.5
308.15 24420.00 1010.6
308.15 26450.00 1011.7
308.15 28470.00 1012.8
308.15 29490.00 1013.2
308.15 30500.00 1013.8
308.15 32530.00 1014.8
308.15 34550.00 1015.8
308.15 36580.00 1016.8
308.15 38600.00 1017.9
308.15 39620.00 1018.3
318.15 100.00 988.3
318.15 2130.00 989.6
318.15 4150.00 990.9
318.15 6180.00 992.1
318.15 8210.00 993.3
318.15 10230.00 994.6
318.15 11250.00 995.2
318.15 12260.00 995.8
318.15 14290.00 997.0
318.15 16310.00 998.1
318.15 18340.00 999.3
318.15 20370.00 1000.4
318.15 22390.00 1001.6
318.15 24420.00 1002.7
318.15 26450.00 1003.8
318.15 28470.00 1004.9
318.15 29490.00 1005.5
318.15 30500.00 1006.0
318.15 32530.00 1007.1
318.15 34550.00 1008.2
318.15 36580.00 1009.2
318.15 38600.00 1010.3
318.15 39620.00 1010.8
328.15 100.00 979.6
328.15 2130.00 981.1
328.15 4150.00 982.4
328.15 6180.00 983.7
328.15 8210.00 985.0
328.15 10230.00 986.2
328.15 11250.00 986.9
328.15 12260.00 987.5
328.15 14290.00 988.7
328.15 16310.00 990.0
328.15 18340.00 991.2
328.15 20370.00 992.3
328.15 22390.00 993.5
328.15 24420.00 994.7
328.15 26450.00 995.9
328.15 28470.00 997.1
328.15 29490.00 997.6
328.15 30500.00 998.2
328.15 32530.00 999.3
328.15 34550.00 1000.4
328.15 36580.00 1001.5
328.15 38600.00 1002.6
328.15 39620.00 1003.2
Reference

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.65] kPa [364.52; 521.91] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.44716e+01
Coefficient B-4.07036e+03
Coefficient C-7.75510e+01
Temperature range, min.364.52
Temperature range, max.521.91
Pvap 1.33 kPa 364.52 Calculated Property
Pvap 3.01 kPa 382.01 Calculated Property
Pvap 6.22 kPa 399.50 Calculated Property
Pvap 11.94 kPa 416.98 Calculated Property
Pvap 21.49 kPa 434.47 Calculated Property
Pvap 36.60 kPa 451.96 Calculated Property
Pvap 59.46 kPa 469.45 Calculated Property
Pvap 92.66 kPa 486.93 Calculated Property
Pvap 139.24 kPa 504.42 Calculated Property
Pvap 202.65 kPa 521.91 Calculated Property

Similar Compounds

1-(2-naphthyl)propan-1-one. 1-Propanone, 3-chloro-1-phenyl-. 1-Propanone, 1-(4-chlorophenyl)-. 1-Propanone, 1-(4-bromophenyl)-. «beta»-Cyanopropiophenone. Isopropyl phenyl ketone. 1,4-Butanedione, 1,4-diphenyl-. 1-Propanone, 3-hydroxy-1-phenyl-. Benzenepropanenitrile, «beta»-oxo-. 1-Propanone, 1-(4-fluorophenyl)-. 1-Butanone, 1-phenyl-. 3-Fluoropropiophenone. 4'-Methylpropiophenone. 1-Propanone, 2-bromo-1-phenyl-. p-Trifluoromethylpropiophenone.

Find more compounds similar to 1-Propanone, 1-phenyl-.

Mixtures

Sources

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