Chemical Properties of Lonazolac, methylated

Lonazolac, methylated

InChI
InChI=1S/C18H15ClN2O2/c1-23-16(22)11-15-17(12-7-9-14(19)10-8-12)21-18(20-15)13-5-3-2-4-6-13/h2-10,18H,11H2,1H3
InChI Key
BHJIVYQLXBERAM-UHFFFAOYSA-N
Formula
C18H15ClN2O2
SMILES
COC(=O)CC1=NC(c2ccccc2)N=C1c1ccc(Cl)cc1
Molecular Weight1
326.78
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Physical Properties

Property Value Unit Source
ΔfusH° 42.93 kJ/mol Joback Calculated Property
ΔvapH° 116.90 kJ/mol Relay (1.0) Calculated Property
IE 8.18 eV Relay (1.0) Calculated Property
logPoct/wat 3.846 Crippen Calculated Property
McVol 237.140 ml/mol McGowan Calculated Property
Inp 2685.00 NIST
Tboil 651.99 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [725.52; 769.87] J/mol×K [914.26; 1183.00] Show Hide
Cp,gas 725.52 J/mol×K 914.26 Joback Calculated Property
Cp,gas 737.98 J/mol×K 959.05 Joback Calculated Property
Cp,gas 748.37 J/mol×K 1003.84 Joback Calculated Property
Cp,gas 756.73 J/mol×K 1048.63 Joback Calculated Property
Cp,gas 763.08 J/mol×K 1093.42 Joback Calculated Property
Cp,gas 767.45 J/mol×K 1138.21 Joback Calculated Property
Cp,gas 769.87 J/mol×K 1183.00 Joback Calculated Property

Similar Compounds

Lonazolac, hydroxy, bis-methylated. Benazepril desethyl 3Me (Benazeprilate 3Me). norbormide. cyclomegistine. Benazepril Me. 5,6-Dihydrouracil riboside, TMS. Nalmefene, bis(trifluoroacetate). (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. 3'-Acetylheliosupine. .delta.1-tetrahydrocannabinolic acid, phenyl-boronate. 4«alpha»-Angeloyloxy-3«beta»-hydroxylupanine. (E)-Methyl 2-((1'R,6'R,7'S,8a'S)-6'-ethyl-2-oxo-3',5',6',7',8',8a'-hexahydro-2'H-spiro[indoline-3,1'-indolizin]-7'-yl)-3-methoxyacrylate. 7-diacetylintermedine. Normorphine, N-trimethylsilyl-, bis(trimethylsilyl) ether. adenosine-3'-monophosphate, TMS.

Find more compounds similar to Lonazolac, methylated.

Sources

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