Chemical Properties of Venlafaxine AC

Venlafaxine AC

InChI
InChI=1S/C19H29NO3/c1-15(21)23-19(12-6-5-7-13-19)18(14-20(2)3)16-8-10-17(22-4)11-9-16/h8-11,18H,5-7,12-14H2,1-4H3
InChI Key
JGOQAINEPLQITA-UHFFFAOYSA-N
Formula
C19H29NO3
SMILES
COc1ccc(C(CN(C)C)C2(OC(C)=O)CCCCC2)cc1
Molecular Weight1
319.44
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Physical Properties

Property Value Unit Source
ΔfusH° 29.21 kJ/mol Joback Calculated Property
logPoct/wat 3.606 Crippen Calculated Property
McVol 267.240 ml/mol McGowan Calculated Property
Inp [2110.00; 2110.00]   Show Hide
Inp 2110.00 NIST
Inp 2110.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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 [824.54; 935.00] J/mol×K [778.41; 998.73] Show Hide
Cp,gas 824.54 J/mol×K 778.41 Joback Calculated Property
Cp,gas 845.22 J/mol×K 815.13 Joback Calculated Property
Cp,gas 864.81 J/mol×K 851.85 Joback Calculated Property
Cp,gas 883.45 J/mol×K 888.57 Joback Calculated Property
Cp,gas 901.28 J/mol×K 925.29 Joback Calculated Property
Cp,gas 918.42 J/mol×K 962.01 Joback Calculated Property
Cp,gas 935.00 J/mol×K 998.73 Joback Calculated Property

Similar Compounds

Venlafaxine-M (O-desmethyl-) 2AC. Venlafaxine-M (O-desmethyl-HO-) isomer-1 2AC. Venlafaxine. Cyclohexanol, 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-. Venlafaxine, trimethylsilyl ether. Venlafaxine-M (O-desmethyl-HO-) isomer-2 2AC. Benazepril Me. Thymidine, 3'-O-acetyl, 5'-O-TBDMS. Benzo[b]-7-oxa-bicyclo[2,2,2]oct-2-en-5(endo),6(exo)-dicarboxylic acid, 4-methyl-1-phenyl, dimethyl ester. Benzo[b]-7-oxa-bicyclo[2,2,2]oct-2-en-5(endo),6(endo)-dicarboxylic acid, 4-methyl-1-phenyl, dimethyl ester. Benzo[b]-7-oxa-bicyclo[2,2,2]oct-2-en-5(exo),6(exo)-dicarboxylic acid, 4-methyl-1-phenyl, dimethyl ester. Benzo[b]-7-oxa-bicyclo[2,2,2]oct-2-en-5(exo),6(endo)-dicarboxylic acid, 4-methyl-1-phenyl, dimethyl ester. Hydromorphone, tert-butyldimethylsilyl ether. 11-EPIHEMANTHAMINE. ERGOTAMINE.

Find more compounds similar to Venlafaxine AC.

Sources

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