Chemical Properties of Bibenzyl (CAS 103-29-7)

Bibenzyl

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InChI
InChI=1S/C14H14/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-10H,11-12H2
InChI Key
QWUWMCYKGHVNAV-UHFFFAOYSA-N
Formula
C14H14
SMILES
c1ccc(CCc2ccccc2)cc1
Molecular Weight1
182.26
CAS
103-29-7
Other Names
  • 1,2-Diphenylethane
  • 1,2-Diphenylethane(sym)
  • 1,2-Diphenylethane, s
  • 2-phenylethylbenzene
  • Benzene, (phenylethyl)-
  • Benzene, 1,1'-(1,2-ethanediyl)bis-
  • DIBENZIL
  • DIHYDROSTILBENE
  • Dibenzyl
  • Ethane, 1,2-diphenyl-
  • NSC 30686
  • s-Diphenylethane
  • sym-Diphenylethane

Physical Properties

Property Value Unit Source
PAff 801.80 kJ/mol NIST
BasG 774.10 kJ/mol NIST
Δcliquid -7562.60 ± 7.50 kJ/mol NIST
Δcsolid [-7594.40; -7280.00] kJ/mol Show Hide
Δcsolid -7561.50 ± 1.10 kJ/mol NIST
Δcsolid -7559.60 ± 1.00 kJ/mol NIST
Δcsolid -7280.00 kJ/mol NIST
Δcsolid -7594.40 kJ/mol NIST
Δcsolid -7554.80 ± 3.00 kJ/mol NIST
Δf 291.82 kJ/mol Joback Calculated Property
Δfgas [129.00; 135.60] kJ/mol Show Hide
Δfgas 135.60 ± 1.30 kJ/mol NIST
Δfgas 129.00 kJ/mol NIST
Δfsolid [44.90; 51.50] kJ/mol Show Hide
Δfsolid 51.50 ± 1.30 kJ/mol NIST
Δfsolid 44.90 ± 3.10 kJ/mol NIST
Δfus 20.10 kJ/mol Joback Calculated Property
Δsub [73.20; 91.50] kJ/mol Show Hide
Δsub 91.50 ± 0.70 kJ/mol NIST
Δsub 91.38 ± 0.46 kJ/mol NIST
Δsub 91.40 ± 0.50 kJ/mol NIST
Δsub 84.10 kJ/mol NIST
Δsub 73.20 ± 0.80 kJ/mol NIST
Δvap 51.31 kJ/mol Joback Calculated Property
IE [8.70; 9.10] eV Show Hide
IE 9.00 ± 0.05 eV NIST
IE 8.70 ± 0.10 eV NIST
IE 9.10 eV NIST
log10WS [-4.62; -4.62]   Show Hide
log10WS -4.62 Aq. Sol...
log10WS -4.62 Estimat...
logPoct/wat 3.472 Crippen Calculated Property
McVol 160.600 ml/mol McGowan Calculated Property
Pc 2770.08 kPa Joback Calculated Property
Inp [258.90; 1563.00]   Show Hide
Inp 1496.70 NIST
Inp 1509.30 NIST
Inp 1546.30 NIST
Inp 1539.00 NIST
Inp 1541.00 NIST
Inp 1563.00 NIST
Inp 1508.80 NIST
Inp 1519.20 NIST
Inp 1524.30 NIST
Inp 1508.80 NIST
Inp 1519.20 NIST
Inp 1524.30 NIST
Inp 1528.00 NIST
Inp 1525.00 NIST
Inp 1494.00 NIST
Inp 1516.00 NIST
Inp 1489.00 NIST
Inp 1487.00 NIST
Inp 260.40 NIST
Inp 260.13 NIST
Inp 260.49 NIST
Inp 258.90 NIST
Inp 260.10 NIST
Inp 260.10 NIST
Inp 1508.80 NIST
Inp 1524.30 NIST
I [2061.00; 2072.00]   Show Hide
I 2069.00 NIST
I 2072.00 NIST
I 2070.00 NIST
I 2061.00 NIST
I 2061.00 NIST
solid,1 bar [267.39; 270.30] J/mol×K Show Hide
solid,1 bar 267.39 J/mol×K NIST
solid,1 bar 270.30 J/mol×K NIST
Tboil 573.08 K Joback Calculated Property
Tc 812.67 K Joback Calculated Property
Tfus [324.95; 325.77] K Show Hide
Tfus 324.95 K KDB
Tfus 325.77 K Aq. Sol...
Ttriple 324.34 ± 0.01 K NIST
Vc 0.604 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [372.34; 460.35] J/mol×K [573.08; 812.67] Show Hide
Cp,gas 372.34 J/mol×K 573.08 Joback Calculated Property
Cp,gas 390.10 J/mol×K 613.01 Joback Calculated Property
Cp,gas 406.52 J/mol×K 652.94 Joback Calculated Property
Cp,gas 421.67 J/mol×K 692.87 Joback Calculated Property
Cp,gas 435.64 J/mol×K 732.81 Joback Calculated Property
Cp,gas 448.51 J/mol×K 772.74 Joback Calculated Property
Cp,gas 460.35 J/mol×K 812.67 Joback Calculated Property
Cp,solid [251.00; 320.10] J/mol×K [293.60; 330.00] Show Hide
Cp,solid 251.00 J/mol×K 293.60 NIST
Cp,solid 251.90 J/mol×K 298.10 NIST
Cp,solid 253.76 J/mol×K 298.15 NIST
Cp,solid 253.60 J/mol×K 298.50 NIST
Cp,solid 257.00 J/mol×K 303.00 NIST
Cp,solid 320.10 J/mol×K 330.00 NIST
η [0.0001783; 0.0026164] Pa×s [300.38; 573.08] Show Hide
η 0.0026164 Pa×s 300.38 Joback Calculated Property
η 0.0012460 Pa×s 345.83 Joback Calculated Property
η 0.0007050 Pa×s 391.28 Joback Calculated Property
η 0.0004491 Pa×s 436.73 Joback Calculated Property
η 0.0003115 Pa×s 482.18 Joback Calculated Property
η 0.0002301 Pa×s 527.63 Joback Calculated Property
η 0.0001783 Pa×s 573.08 Joback Calculated Property
ΔfusH [2.25; 23.01] kJ/mol [273.20; 324.40] Show Hide
ΔfusH 2.25 kJ/mol 273.20 NIST
ΔfusH 22.73 kJ/mol 324.30 NIST
ΔfusH 22.57 kJ/mol 324.30 NIST
ΔfusH 22.73 kJ/mol 324.30 NIST
ΔfusH 23.01 kJ/mol 324.40 NIST
ΔsubH [72.40; 92.90] kJ/mol [295.50; 326.20] Show Hide
ΔsubH 91.20 ± 0.40 kJ/mol 295.50 NIST
ΔsubH 84.10 ± 0.40 kJ/mol 296.50 NIST
ΔsubH 72.40 ± 1.30 kJ/mol 303.50 NIST
ΔsubH 92.90 kJ/mol 308.00 NIST
ΔsubH 83.97 ± 0.46 kJ/mol 326.20 NIST
ΔvapH [57.00; 67.53] kJ/mol [324.40; 458.00] Show Hide
ΔvapH 67.53 ± 0.10 kJ/mol 324.40 NIST
ΔvapH 66.20 ± 0.20 kJ/mol 340.00 NIST
ΔvapH 64.10 kJ/mol 373.00 NIST
ΔvapH 67.40 kJ/mol 398.00 NIST
ΔvapH 57.00 kJ/mol 458.00 NIST
ΔfusS [8.23; 70.90] J/mol×K [273.20; 324.40] Show Hide
ΔfusS 8.23 J/mol×K 273.20 NIST
ΔfusS 70.09 J/mol×K 324.30 NIST
ΔfusS 70.90 J/mol×K 324.40 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.65] kPa [410.70; 591.81] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.46161e+01
Coefficient B-4.80619e+03
Coefficient C-7.52760e+01
Temperature range, min.410.70
Temperature range, max.591.81
Pvap 1.33 kPa 410.70 Calculated Property
Pvap 3.00 kPa 430.82 Calculated Property
Pvap 6.19 kPa 450.95 Calculated Property
Pvap 11.86 kPa 471.07 Calculated Property
Pvap 21.34 kPa 491.19 Calculated Property
Pvap 36.37 kPa 511.32 Calculated Property
Pvap 59.15 kPa 531.44 Calculated Property
Pvap 92.32 kPa 551.56 Calculated Property
Pvap 138.97 kPa 571.69 Calculated Property
Pvap 202.65 kPa 591.81 Calculated Property
Pvap [9.53e-03; 2719.16] kPa [324.34; 780.00] KDB Vap... Show Hide
Equationln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A1.13283e+02
Coefficient B-1.22009e+04
Coefficient C-1.39952e+01
Coefficient D5.69580e-06
Temperature range, min.324.34
Temperature range, max.780.00
Pvap 9.53e-03 kPa 324.34 Calculated Property
Pvap 0.25 kPa 374.97 Calculated Property
Pvap 2.53 kPa 425.60 Calculated Property
Pvap 14.32 kPa 476.23 Calculated Property
Pvap 54.56 kPa 526.86 Calculated Property
Pvap 158.20 kPa 577.48 Calculated Property
Pvap 379.31 kPa 628.11 Calculated Property
Pvap 795.72 kPa 678.74 Calculated Property
Pvap 1519.68 kPa 729.37 Calculated Property
Pvap 2719.16 kPa 780.00 Calculated Property

Similar Compounds

[2.2]Paracyclophane. Benzene, 1,1'-(1,2-ethanediyl)bis[4-methyl-. Benzene, 1-fluoro-4-(2-phenylethyl)-. Benzene, 1-bromo-4-(2-phenylethyl)-. Benzene, 1-iodo-4-(2-phenylethyl)-. (2.2)Metacyclophane. Pentacyclo[10.4.4.4<sup>4,9</sup>.0<sup>6,23</sup>.0<sup>15,19</sup>]tetracosa-4,6,8,12,14,16,17,21,23-decaene. Pentacyclo[11.5.3.34,10.07,23.016,20]tetracosa-1(19)4,6,8,10,(22),13,15,17,20,23-decaene. 2,2-Metaparacyclophane. Phenol, 4-(2-phenylethyl)-. Ethanone, 1-[4-(2-phenylethyl)phenyl]-. Benzonitrile, m-phenethyl-. Bicyclo[4.2.0]octa-1,3,5-triene. Benzene, 1-methoxy-4-(2-phenylethyl)-. Bibenzyl, 3-chloro-.

Find more compounds similar to Bibenzyl.

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