Chemical Properties of Fumaric acid, monoamide, N-benzyl-N-phenethyl-, 3-fluorophenyl ester

Fumaric acid, monoamide, N-benzyl-N-phenethyl-, 3-fluorophenyl ester

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InChI
InChI=1S/C25H22FNO3/c26-22-12-7-13-23(18-22)30-25(29)15-14-24(28)27(19-21-10-5-2-6-11-21)17-16-20-8-3-1-4-9-20/h1-15,18H,16-17,19H2/b15-14+
InChI Key
NELJQPRPADOPOH-CCEZHUSRSA-N
Formula
C25H22FNO3
SMILES
O=C(C=CC(=O)N(CCc1ccccc1)Cc1ccccc1)Oc1cccc(F)c1
Molecular Weight1
403.45
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Physical Properties

Property Value Unit Source
Δf 120.57 kJ/mol Joback Calculated Property
Δfgas -229.95 kJ/mol Joback Calculated Property
Δfus 52.93 kJ/mol Joback Calculated Property
Δvap 95.82 kJ/mol Joback Calculated Property
log10WS -6.13 Crippen Calculated Property
logPoct/wat 4.559 Crippen Calculated Property
McVol 308.290 ml/mol McGowan Calculated Property
Pc 1567.23 kPa Joback Calculated Property
Inp [3342.00; 3342.00]   Show Hide
Inp 3342.00 NIST
Inp 3342.00 NIST
Tboil 1002.45 K Joback Calculated Property
Tc 1244.79 K Joback Calculated Property
Tfus 613.36 K Joback Calculated Property
Vc 1.157 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [962.35; 1026.17] J/mol×K [1002.45; 1244.79] Show Hide
Cp,gas 962.35 J/mol×K 1002.45 Joback Calculated Property
Cp,gas 975.09 J/mol×K 1042.84 Joback Calculated Property
Cp,gas 986.80 J/mol×K 1083.23 Joback Calculated Property
Cp,gas 997.62 J/mol×K 1123.62 Joback Calculated Property
Cp,gas 1007.70 J/mol×K 1164.01 Joback Calculated Property
Cp,gas 1017.17 J/mol×K 1204.40 Joback Calculated Property
Cp,gas 1026.17 J/mol×K 1244.79 Joback Calculated Property

Similar Compounds

Fumaric acid, monoamide, N-benzyl-N-phenethyl-, 2-fluorophenyl ester. Fumaric acid, monoamide, N-benzyl-N-phenethyl-, 3,5-difluorophenyl ester. Fumaric acid, monoamide, N-benzyl-N-phenethyl-, pentafluorobenzyl ester. Fumaric acid, monoamide, N-benzyl-N-phenethyl-, 2-ethylhexyl ester. Fumaric acid, monoamide, N-benzyl-N-phenethyl-, isopropyl ester. Tryptophan-leucine-methionine,N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. Fumaric acid, monoamide, N-benzyl-N-phenethyl-, 2-pentyl ester. 2-(2-furyl)-3-hydroxypiperidine. 2-(5-methyl-2-furyl)-3-hydroxy-piperidine. 1-Alpha-2-methyl-8-methoxy-6,7-methylenedioxy-1-(6,7-dimethoxy-3-phthalidyl)-1,2,3,4-tetrahydroisoquinoline. Noscapine. Butorphanol di-TMS derivative. 1,2,3,4-Tetrahydroanthracene-cis-1,2-diol, ferrocenylboronate. Moexipril Me. Moexipril desethyl 3Me (Moexprilate 3Me).

Find more compounds similar to Fumaric acid, monoamide, N-benzyl-N-phenethyl-, 3-fluorophenyl ester.

Sources

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