Chemical Properties of 2,6-Pyridinedicarbamic acid, 4-chloro-, dibenzyl ester

2,6-Pyridinedicarbamic acid, 4-chloro-, dibenzyl ester

InChI
InChI=1S/C21H18ClN3O4/c22-17-11-18(24-20(26)28-13-15-7-3-1-4-8-15)23-19(12-17)25-21(27)29-14-16-9-5-2-6-10-16/h1-12H,13-14H2,(H2,23,24,25,26,27)
InChI Key
JLBWTVWMYOEKTK-UHFFFAOYSA-N
Formula
C21H18ClN3O4
SMILES
O=C(Nc1cc(Cl)cc(NC(=O)OCc2ccccc2)n1)OCc1ccccc1
Molecular Weight1
411.84
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Physical Properties

Property Value Unit Source
Δvap 155.10 kJ/mol Relay (1.0) Calculated Property
log10WS -6.17 Relay (1.0) Calculated Property
logPoct/wat 5.232 Crippen Calculated Property
McVol 292.530 ml/mol McGowan Calculated Property
Tboil 704.76 K Relay (1.0) Calculated Property
Tfus 423.58 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

4-[2-(4-Allyl-2,6-dimethoxy-phenoxy)-1-hydroxy-propyl]-2,6-dimethoxy-phenol, TPS. Piroxicam. 4-[2-(4-Allyl-2,6-dimethoxy-phenoxy)-1-hydroxy-propyl]-2-methoxy-phenol, TPS. DILTIAZEM, M(O-DESMETHYL-DESAMINO-HO-), AC. DILTIAZEM, M(DESAMINO-HO-), AC. DILTIAZEM, M(ODESMETHYL-), AC. SCHEMBL9488362. Diltiazem. Isooctylhydrocupreine. 2-Piperidinomethyl-8(ar)-methoxy-tetrahydro-1-acenaphthone. trans-Anthracene, 1,2-dihydro-1,2-diol, bis-TMS. 2-Pyridinecarbamic acid, 6-amino-4-[[2-hydroxy-3-(methylphenylamino)propyl]amino]-5-nitro-, ethyl ester. N-Methyl-2,3-dihydroxymorphinan. Pentazocine, trimethylsilyl ether. irbesartan.

Find more compounds similar to 2,6-Pyridinedicarbamic acid, 4-chloro-, dibenzyl ester.

Sources

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