Chemical Properties of DIMETHYL 4,4'-BIPHENYLDICARBOXYLATE

DIMETHYL 4,4'-BIPHENYLDICARBOXYLATE

InChI
InChI=1S/C16H14O4/c1-19-15(17)13-7-3-11(4-8-13)12-5-9-14(10-6-12)16(18)20-2/h3-10H,1-2H3
InChI Key
BKRIRZXWWALTPU-UHFFFAOYSA-N
Formula
C16H14O4
SMILES
COC(=O)c1ccc(-c2ccc(C(=O)OC)cc2)cc1
Molecular Weight1
270.28
Other Names
  • 4,4'-Biphenyldicarboxylic acid, dimethyl ester
  • 4,4'-Bis(methoxycarbonyl)biphenyl
  • 4,4-Dicarboxymethylbiphenyl
  • Dimethyl (1,1'-biphenyl)-4,4'-dicarboxylate
  • Dimethyl biphenyl-4,4'-dicarboxylate
  • [1,1'-Biphenyl]-4,4'-dicarboxylic acid, dimethyl ester
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Physical Properties

Property Value Unit Source
ω 0.7307 Relay (1.0) Calculated Property
ΔfH°gas -522.58 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 33.24 kJ/mol Joback Calculated Property
ΔvapH° 111.07 kJ/mol Relay (1.0) Calculated Property
IE 9.15 ± 0.05 eV NIST
log10WS -4.51 Relay (1.0) Calculated Property
logPoct/wat 2.927 Crippen Calculated Property
McVol 203.660 ml/mol McGowan Calculated Property
Pc 2241.88 kPa Joback Calculated Property
Tboil 642.99 K Relay (1.0) Calculated Property
Tc 877.63 K Relay (1.0) Calculated Property
Tfus 487.15 K Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value
Vc 0.750 m3/kmol Relay (1.0) Calculated Property

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [268.16; 617.87] 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-5.00000e-02
Coefficient B1.13744e+00
Coefficient C-5.85720e-04
Coefficient D6.62000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 268.16 J/mol×K 273.00 Calculated Property
Cp,gas 331.97 J/mol×K 353.78 Calculated Property
Cp,gas 389.06 J/mol×K 434.56 Calculated Property
Cp,gas 439.62 J/mol×K 515.33 Calculated Property
Cp,gas 483.88 J/mol×K 596.11 Calculated Property
Cp,gas 522.04 J/mol×K 676.89 Calculated Property
Cp,gas 554.31 J/mol×K 757.67 Calculated Property
Cp,gas 580.89 J/mol×K 838.44 Calculated Property
Cp,gas 602.01 J/mol×K 919.22 Calculated Property
Cp,gas 617.87 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0004602; 0.0001007] Pa×s [487.15; 685.29] 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-1.29405e+01
Coefficient B2.56076e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.487.15
Temperature range, max.685.29
η 0.0004602 Pa×s 487.15 Calculated Property
η 0.0003666 Pa×s 509.17 Calculated Property
η 0.0002976 Pa×s 531.18 Calculated Property
η 0.0002457 Pa×s 553.20 Calculated Property
η 0.0002058 Pa×s 575.21 Calculated Property
η 0.0001746 Pa×s 597.23 Calculated Property
η 0.0001499 Pa×s 619.24 Calculated Property
η 0.0001301 Pa×s 641.26 Calculated Property
η 0.0001140 Pa×s 663.28 Calculated Property
η 0.0001007 Pa×s 685.29 Calculated Property

Similar Compounds

Methyl-p-phneylbenzoate. Diethyl biphenyl-4,4'-dicarboxylate. BIPHENYL-4-CARBOXYLIC ACID. 4,4'-Biphthalic anhydride. [1,1'-Biphenyl]-4-carboxaldehyde. 1,4-Benzenedicarboxylic acid, dimethyl ester. Benzoic acid, methyl ester. BENZOIC ACID, 4-METHYL-, METHYL ESTER. 1,1'-BIPHENYL, 2-CARBOXY ACID. poly(ethylene terephthalate). 4'-Ethyl-4-biphenylcarboxylic acid. Benzoic acid, 4-cyano-, methyl ester. Methanone, [1,1'-biphenyl]-4-ylphenyl-. Benzoic acid, 4-formyl-, methyl ester. 4-Fluorobenzoic acid, methyl ester.

Find more compounds similar to DIMETHYL 4,4'-BIPHENYLDICARBOXYLATE.

Sources

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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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