Chemical Properties of 3-[4-(4-Aminobenzyl)anilino]-2-benzofuran-1(3h)-one (CAS 110194-18-8)

3-[4-(4-Aminobenzyl)anilino]-2-benzofuran-1(3h)-one

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InChI
InChI=1S/C21H18N2O2/c22-16-9-5-14(6-10-16)13-15-7-11-17(12-8-15)23-20-18-3-1-2-4-19(18)21(24)25-20/h1-12,20,23H,13,22H2
InChI Key
OLSMFJRLHSJFQC-UHFFFAOYSA-N
Formula
C21H18N2O2
SMILES
Nc1ccc(Cc2ccc(NC3OC(=O)c4ccccc43)cc2)cc1
Molecular Weight1
330.38
CAS
110194-18-8
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Physical Properties

Property Value Unit Source
ΔfG° 442.16 kJ/mol Joback Calculated Property
ΔfH°gas 88.77 kJ/mol Joback Calculated Property
ΔfusH° 47.02 kJ/mol Joback Calculated Property
ΔvapH° 96.90 kJ/mol Joback Calculated Property
log10WS -5.50 Crippen Calculated Property
logPoct/wat 4.141 Crippen Calculated Property
McVol 252.010 ml/mol McGowan Calculated Property
Pc 2356.49 kPa Joback Calculated Property
Tboil 999.07 K Joback Calculated Property
Tc 1270.90 K Joback Calculated Property
Tfus 691.90 K Joback Calculated Property
Vc 0.936 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [809.02; 867.00] J/mol×K [999.07; 1270.90] Show Hide
Cp,gas 809.02 J/mol×K 999.07 Joback Calculated Property
Cp,gas 821.47 J/mol×K 1044.38 Joback Calculated Property
Cp,gas 832.62 J/mol×K 1089.68 Joback Calculated Property
Cp,gas 842.62 J/mol×K 1134.99 Joback Calculated Property
Cp,gas 851.60 J/mol×K 1180.29 Joback Calculated Property
Cp,gas 859.68 J/mol×K 1225.60 Joback Calculated Property
Cp,gas 867.00 J/mol×K 1270.90 Joback Calculated Property

Similar Compounds

3-(4-Hydroxyanilino)-2-benzofuran-1(3h)-one. 3,3'(P-phenylene diimino) diphthalide. 2-[(3-Oxo-1,3-dihydro-2-benzofuran-1-yl)amino]benzoic acid. Oxycodone. Naloxone, bis(trimethylsilyl) ether. Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-(2-propenyl)-, (5«alpha»)-. Oxymorphone, bis(trimethylsilyl) ether. Naloxone. Naltrexone. Nalbuphine, O,O,O-tris(trimethylsilyl) deriv.. Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-, (5«alpha»)-. Oxymorphone. Oxycodone, trimethylsilyl ether. Oxycodone TMS derivative. Codeine.

Find more compounds similar to 3-[4-(4-Aminobenzyl)anilino]-2-benzofuran-1(3h)-one.

Sources

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