Chemical Properties of carbutamide

InChI

InChI=1S/C11H17N3O3S/c1-2-3-8-13-11(15)14-18(16,17)10-6-4-9(12)5-7-10/h4-7H,2-3,8,12H2,1H3,(H2,13,14,15)

InChI Key

VDTNNGKXZGSZIP-UHFFFAOYSA-N

Formula

C11H17N3O3S

SMILES

CCCCNC(=O)NS(=O)(=O)c1ccc(N)cc1

Molecular Weight¹

271.34

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, 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 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[283.81; 633.26]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			1.79530e+01
Coefficient B			1.13031e+00
Coefficient C			-5.95060e-04
Coefficient D			8.00600e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	283.81	J/mol×K	273.00	Calculated Property
Cp,gas	346.90	J/mol×K	353.78	Calculated Property
Cp,gas	403.34	J/mol×K	434.56	Calculated Property
Cp,gas	453.37	J/mol×K	515.33	Calculated Property
Cp,gas	497.25	J/mol×K	596.11	Calculated Property
Cp,gas	535.23	J/mol×K	676.89	Calculated Property
Cp,gas	567.57	J/mol×K	757.67	Calculated Property
Cp,gas	594.52	J/mol×K	838.44	Calculated Property
Cp,gas	616.34	J/mol×K	919.22	Calculated Property
Cp,gas	633.26	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to carbutamide.

Sources

• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Joback Method
• Aqueous Solubility Prediction Method
• McGowan Method

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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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