Chemical Properties of Benzene, 1,3-diethyl-5-methyl- (CAS 2050-24-0)

Benzene, 1,3-diethyl-5-methyl-

InChI
InChI=1S/C11H16/c1-4-10-6-9(3)7-11(5-2)8-10/h6-8H,4-5H2,1-3H3
InChI Key
HILAULICMJUOLK-UHFFFAOYSA-N
Formula
C11H16
SMILES
CCc1cc(C)cc(CC)c1
Molecular Weight1
148.24
CAS
2050-24-0
Other Names
  • 1,3-Diethyl-5-methylbenzene
  • 1-Methyl-3,5-diethylbenzene
  • 3,5-Diethyltoluene
  • Benzene, 3,5-diethyl-1-methyl
  • Toluene, 3,5-diethyl-
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Physical Properties

Property Value Unit Source
ω 0.4433 Relay (1.0) Calculated Property
ΔfG° 134.89 kJ/mol Joback Calculated Property
ΔfH°gas -46.15 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 17.51 kJ/mol Joback Calculated Property
ΔvapH° 56.72 kJ/mol Relay (1.0) Calculated Property
IE 8.22 eV Relay (1.0) Calculated Property
log10WS -4.35 Relay (1.0) Calculated Property
logPoct/wat 3.120 Crippen Calculated Property
McVol 142.090 ml/mol McGowan Calculated Property
Pc 2598.00 kPa KDB
Inp [1120.00; 1151.00]   Show Hide
Inp 1130.90 NIST
Inp 1120.00 NIST
Inp 1120.00 NIST
Inp 1129.80 NIST
Inp 1129.60 NIST
Inp 1130.60 NIST
Inp 1130.00 NIST
Inp 1134.00 NIST
Inp 1144.00 NIST
Inp 1130.00 NIST
Inp 1151.00 NIST
Inp 1150.80 NIST
Inp 1143.00 NIST
Inp 1130.00 NIST
Inp 1130.00 NIST
Inp 1130.00 NIST
I [1365.00; 1429.00]   Show Hide
I 1397.00 NIST
I 1388.00 NIST
I 1365.00 NIST
I 1365.00 NIST
I 1397.00 NIST
I 1398.00 NIST
I 1409.00 NIST
I 1421.00 NIST
I 1429.00 NIST
I 1388.00 NIST
I 1365.00 NIST
I 1365.00 NIST
Tboil [471.00; 478.20] K Show Hide
Tboil 478.20 K KDB
Tboil 473.85 ± 0.20 K NIST
Tboil 472.00 ± 3.00 K NIST
Tboil 471.00 ± 6.00 K NIST
Tc 673.30 K KDB
Tfus [199.00; 199.03] K Show Hide
Tfus 199.00 K KDB
Tfus 199.03 ± 0.20 K NIST
Vc 0.551 m3/kmol KDB
Zc 0.2557550 KDB

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔvapH 49.60 kJ/mol 390.50 NIST
ρl 874.66 kg/m3 293.10 KDB

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [186.68; 462.22] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-1.24180e+01
Coefficient B8.50960e-01
Coefficient C-4.71720e-04
Coefficient D9.54000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 186.68 J/mol×K 273.00 Calculated Property
Cp,gas 233.82 J/mol×K 353.78 Calculated Property
Cp,gas 276.12 J/mol×K 434.56 Calculated Property
Cp,gas 313.89 J/mol×K 515.33 Calculated Property
Cp,gas 347.43 J/mol×K 596.11 Calculated Property
Cp,gas 377.04 J/mol×K 676.89 Calculated Property
Cp,gas 403.02 J/mol×K 757.67 Calculated Property
Cp,gas 425.68 J/mol×K 838.44 Calculated Property
Cp,gas 445.31 J/mol×K 919.22 Calculated Property
Cp,gas 462.22 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0089958; 0.0002208] Pa×s [199.01; 471.31] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.11281e+01
Coefficient B1.27710e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
Temperature range, min.199.01
Temperature range, max.471.31
η 0.0089958 Pa×s 199.01 Calculated Property
η 0.0038572 Pa×s 229.27 Calculated Property
η 0.0020149 Pa×s 259.52 Calculated Property
η 0.0012054 Pa×s 289.78 Calculated Property
η 0.0007947 Pa×s 320.03 Calculated Property
η 0.0005630 Pa×s 350.29 Calculated Property
η 0.0004213 Pa×s 380.54 Calculated Property
η 0.0003291 Pa×s 410.80 Calculated Property
η 0.0002659 Pa×s 441.05 Calculated Property
η 0.0002208 Pa×s 471.31 Calculated Property
Property Value Unit Temperature (K) Source
Pvap [1.33; 202.66] kPa [346.44; 505.04] The Yaws Handbook of Vapor Pressure Show Hide
Equationln(Y) = A + B/(T + C)
Y is Pvap in kPa, T in K
Coefficient A1.48010e+01
Coefficient B-4.34775e+03
Coefficient C-4.68740e+01
Temperature range, min.346.44
Temperature range, max.505.04
Pvap 1.33 kPa 346.44 Calculated Property
Pvap 2.99 kPa 364.06 Calculated Property
Pvap 6.14 kPa 381.68 Calculated Property
Pvap 11.76 kPa 399.31 Calculated Property
Pvap 21.16 kPa 416.93 Calculated Property
Pvap 36.09 kPa 434.55 Calculated Property
Pvap 58.78 kPa 452.17 Calculated Property
Pvap 91.90 kPa 469.80 Calculated Property
Pvap 138.65 kPa 487.42 Calculated Property
Pvap 202.66 kPa 505.04 Calculated Property
Pvap [0.13; 101.94] kPa [307.15; 474.15] KDB Vapor Pressure Data Show Hide
Equationln(Y) = A + B/T + C·ln(T) + D·T² + E/T²
Y is Pvap in kPa, T in K
Coefficient A5.68039e+01
Coefficient B-7.64368e+03
Coefficient C-5.98248e+00
Coefficient D3.56913e-06
Coefficient E0.00000e+00
Temperature range, min.307.15
Temperature range, max.474.15
Pvap 0.13 kPa 307.15 Calculated Property
Pvap 0.41 kPa 325.71 Calculated Property
Pvap 1.08 kPa 344.26 Calculated Property
Pvap 2.58 kPa 362.82 Calculated Property
Pvap 5.60 kPa 381.37 Calculated Property
Pvap 11.24 kPa 399.93 Calculated Property
Pvap 21.11 kPa 418.48 Calculated Property
Pvap 37.43 kPa 437.04 Calculated Property
Pvap 63.12 kPa 455.59 Calculated Property
Pvap 101.94 kPa 474.15 Calculated Property
Pvap [0.13; 101.08] kPa [307.00; 473.90] NIST Show Hide
Equationln(Y) = A + B/(T + C)
Y is Pvap in kPa, T in K
Coefficient A1.54797e+01
Coefficient B-4.78191e+03
Coefficient C-3.37310e+01
ReferenceStull, 1947
Temperature range, min.307.00
Temperature range, max.473.90
Pvap 0.13 kPa 307.00 Calculated Property
Pvap 0.40 kPa 325.54 Calculated Property
Pvap 1.07 kPa 344.09 Calculated Property
Pvap 2.56 kPa 362.63 Calculated Property
Pvap 5.57 kPa 381.18 Calculated Property
Pvap 11.18 kPa 399.72 Calculated Property
Pvap 20.99 kPa 418.27 Calculated Property
Pvap 37.20 kPa 436.81 Calculated Property
Pvap 62.68 kPa 455.36 Calculated Property
Pvap 101.08 kPa 473.90 Calculated Property

Similar Compounds

Benzene, 1,3,5-triethyl-. Benzene, 1-ethyl-3,5-dimethyl-. Benzene, 1,3-diethyl-. Benzene, 1-ethyl-3-methyl-. Benzene, 1-ethyl-3,5-diisopropyl-. Benzene, 1-(1,1-dimethylethyl)-3-ethyl-5-methyl-. Benzene, 1-ethyl-3,4,5-trimethyl. Benzene, 1-methyl-3,5-bis(1-methylethyl)-. Benzene, 1,3-dimethyl-5-(1-methylethyl)-. [2.2.2](1,3,5)Cyclophane. 3-Ethyl-5-methylbenzyl alcohol. Benzene, 1,3-dimethyl-5-propyl-. Benzene, 4-ethyl-1,2-dimethyl-. 1,6-Dimethyl-2,4-diethylbenzene. 1,4-Dimethyl-3,5-diethylbenzene.

Find more compounds similar to Benzene, 1,3-diethyl-5-methyl-.

Sources

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