Chemical Properties of 2-methylamino-5-amino-2'-fluoro-benzophenone, acetylated

InChI

InChI=1S/C18H17FN2O3/c1-11(22)20-13-8-9-17(21(3)12(2)23)15(10-13)18(24)14-6-4-5-7-16(14)19/h4-10H,1-3H3,(H,20,22)

InChI Key

SUUGLAZBOARLSU-UHFFFAOYSA-N

Formula

C18H17FN2O3

SMILES

CC(=O)Nc1ccc(N(C)C(C)=O)c(C(=O)c2ccccc2F)c1

Molecular Weight¹

328.34

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization 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).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	-84.79	kJ/mol	Joback Calculated Property
ΔfH°gas	-389.05	kJ/mol	Joback Calculated Property
ΔfusH°	45.29	kJ/mol	Joback Calculated Property
ΔvapH°	90.10	kJ/mol	Joback Calculated Property
log10WS	-4.07		Crippen Calculated Property
logPoct/wat	2.998		Crippen Calculated Property
McVol	243.400	ml/mol	McGowan Calculated Property
Pc	2115.83	kPa	Joback Calculated Property
Inp	[2870.00; 2870.00]
Inp	2870.00		NIST
Inp	2870.00		NIST
Tboil	903.03	K	Joback Calculated Property
Tc	1132.66	K	Joback Calculated Property
Tfus	618.53	K	Joback Calculated Property
Vc	0.916	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[723.76; 778.32]	J/mol×K	[903.03; 1132.66]
Cp,gas	723.76	J/mol×K	903.03	Joback Calculated Property
Cp,gas	735.24	J/mol×K	941.30	Joback Calculated Property
Cp,gas	745.68	J/mol×K	979.57	Joback Calculated Property
Cp,gas	755.13	J/mol×K	1017.85	Joback Calculated Property
Cp,gas	763.68	J/mol×K	1056.12	Joback Calculated Property
Cp,gas	771.39	J/mol×K	1094.39	Joback Calculated Property
Cp,gas	778.32	J/mol×K	1132.66	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-methylamino-5-amino-2'-fluoro-benzophenone, acetylated.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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