Chemical Properties of Benzenesulfonamide, 4-methyl-N-ethyl-N-pentyl-

InChI

InChI=1S/C14H23NO2S/c1-4-6-7-12-15(5-2)18(16,17)14-10-8-13(3)9-11-14/h8-11H,4-7,12H2,1-3H3

InChI Key

FUNQQIFBSVLTMW-UHFFFAOYSA-N

Formula

C14H23NO2S

SMILES

CCCCCN(CC)S(=O)(=O)c1ccc(C)cc1

Molecular Weight¹

269.40

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• 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).
• I_np : Non-polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-360.38	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	40.07	kJ/mol	Joback Calculated Property
log10WS	-4.76		Relay (1.0) Calculated Property
logPoct/wat	3.196		Crippen Calculated Property
McVol	222.430	ml/mol	McGowan Calculated Property
Inp	[2238.00; 2238.00]
Inp	2238.00		NIST
Inp	2238.00		NIST
Tfus	316.18	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, 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	[309.29; 727.30]	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			-6.89500e+00
Coefficient B			1.35295e+00
Coefficient C			-7.48960e-04
Coefficient D			1.30200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	309.29	J/mol×K	273.00	Calculated Property
Cp,gas	383.77	J/mol×K	353.78	Calculated Property
Cp,gas	450.29	J/mol×K	434.56	Calculated Property
Cp,gas	509.24	J/mol×K	515.33	Calculated Property
Cp,gas	561.05	J/mol×K	596.11	Calculated Property
Cp,gas	606.12	J/mol×K	676.89	Calculated Property
Cp,gas	644.87	J/mol×K	757.67	Calculated Property
Cp,gas	677.71	J/mol×K	838.44	Calculated Property
Cp,gas	705.05	J/mol×K	919.22	Calculated Property
Cp,gas	727.30	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Benzenesulfonamide, 4-methyl-N-ethyl-N-pentyl-.

Sources

• Cheméo Relay (1.0)
• 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
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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