Chemical Properties of Napropamide (CAS 15299-99-7)

InChI

InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3

InChI Key

WXZVAROIGSFCFJ-UHFFFAOYSA-N

Formula

C17H21NO2

SMILES

CCN(CC)C(=O)C(C)Oc1cccc2ccccc12

Molecular Weight¹

271.35

CAS

15299-99-7

Other Names

• Propanamide, N,N-diethyl-2-(1-naphthalenyloxy)-
• Propionamide, N,N-diethyl-2-(1-naphthyloxy)-
• Devrinol
• Napropamid
• R 7465
• Napromide
• 2-(«alpha»-Naphthoxy)-N,N-Diethylpropionamide
• N,N-Diethyl-2-(1-naphthalenyloxy)propionamide
• Racemic devrinol
• N,N-diethyl-2-(1-naphthyloxy)propionamide

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• 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_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	32.74	kJ/mol	Joback Calculated Property
IE	7.69	eV	Relay (1.0) Calculated Property
log10WS	-3.05		Relay (1.0) Calculated Property
logPoct/wat	3.475		Crippen Calculated Property
McVol	224.590	ml/mol	McGowan Calculated Property
Inp	[2119.00; 2165.00]
Inp	2119.00		NIST
Inp	2160.00		NIST
Inp	2148.00		NIST
Inp	2165.00		NIST
Inp	2148.00		NIST
Inp	2119.00		NIST
Inp	2165.00		NIST
Inp	2148.00		NIST
Tboil	618.84	K	Relay (1.0) Calculated Property
Tfus	346.97 ± 0.20	K	NIST

Cheméo can also estimate 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 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[301.93; 730.11]	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			-4.31280e+01
Coefficient B			1.51536e+00
Coefficient C			-9.87980e-04
Coefficient D			2.45860e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	301.93	J/mol×K	273.00	Calculated Property
Cp,gas	380.20	J/mol×K	353.78	Calculated Property
Cp,gas	448.99	J/mol×K	434.56	Calculated Property
Cp,gas	509.06	J/mol×K	515.33	Calculated Property
Cp,gas	561.20	J/mol×K	596.11	Calculated Property
Cp,gas	606.18	J/mol×K	676.89	Calculated Property
Cp,gas	644.79	J/mol×K	757.67	Calculated Property
Cp,gas	677.79	J/mol×K	838.44	Calculated Property
Cp,gas	705.97	J/mol×K	919.22	Calculated Property
Cp,gas	730.11	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Napropamide.

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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