Chemical Properties of 1,4-Naphthalenediamine (CAS 2243-61-0)

1,4-Naphthalenediamine

InChI
InChI=1S/C10H10N2/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6H,11-12H2
InChI Key
OKBVMLGZPNDWJK-UHFFFAOYSA-N
Formula
C10H10N2
SMILES
Nc1ccc(N)c2ccccc12
Molecular Weight1
158.20
CAS
2243-61-0
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Physical Properties

Property Value Unit Source
ω 0.5901 Relay (1.0) Calculated Property
ΔfG° 366.02 kJ/mol Joback Calculated Property
ΔfH°gas 155.12 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 22.33 kJ/mol Joback Calculated Property
ΔvapH° 86.03 kJ/mol Relay (1.0) Calculated Property
IE 7.02 eV Relay (1.0) Calculated Property
log10WS -2.45 Relay (1.0) Calculated Property
logPoct/wat 2.004 Crippen Calculated Property
McVol 128.500 ml/mol McGowan Calculated Property
Pc 4339.67 kPa Joback Calculated Property
Tboil 609.05 K Relay (1.0) Calculated Property
Tc 896.44 K Relay (1.0) Calculated Property
Tfus 393.15 K Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value
Vc 0.439 m3/kmol Relay (1.0) Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [165.21; 391.79] 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-2.99700e+01
Coefficient B8.76000e-01
Coefficient C-6.40840e-04
Coefficient D1.86600e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 165.21 J/mol×K 273.00 Calculated Property
Cp,gas 207.99 J/mol×K 353.78 Calculated Property
Cp,gas 245.00 J/mol×K 434.56 Calculated Property
Cp,gas 276.81 J/mol×K 515.33 Calculated Property
Cp,gas 304.03 J/mol×K 596.11 Calculated Property
Cp,gas 327.24 J/mol×K 676.89 Calculated Property
Cp,gas 347.03 J/mol×K 757.67 Calculated Property
Cp,gas 363.99 J/mol×K 838.44 Calculated Property
Cp,gas 378.71 J/mol×K 919.22 Calculated Property
Cp,gas 391.79 J/mol×K 1000.00 Calculated Property

Similar Compounds

1,5-Naphthalenediamine. 1-Naphthalenamine. 1-Aminoanthracene. 1-Aminopyrene. 1-Aminophenanthrene. Benzo[c]phenanthrene, 4-amino. 6-Chrysenamine. 9-Phenanthrenamine. Benzo[a]pyrene, 7-amino. 4-Pyrenamine. Phenanthrene, 4-amino. 1,8-Naphthalenediamine. 2-Naphthalenamine. 9-Aminoanthracene. 2-Anthracenamine.

Find more compounds similar to 1,4-Naphthalenediamine.

Sources

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