Chemical Properties of Acetamide, N-(2-iodo-4-methylphenyl)-2-acetoxy-

InChI

InChI=1S/C11H12INO3/c1-7-3-4-10(9(12)5-7)13-11(15)6-16-8(2)14/h3-5H,6H2,1-2H3,(H,13,15)

InChI Key

KOZRCZQJHRNZSB-UHFFFAOYSA-N

Formula

C11H12INO3

SMILES

CC(=O)OCC(=O)Nc1ccc(C)cc1I

Molecular Weight¹

333.12

• 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°	-80.44	kJ/mol	Joback Calculated Property
ΔfH°gas	-283.82	kJ/mol	Joback Calculated Property
ΔfusH°	31.40	kJ/mol	Joback Calculated Property
ΔvapH°	75.39	kJ/mol	Joback Calculated Property
log10WS	-3.00		Crippen Calculated Property
logPoct/wat	2.101		Crippen Calculated Property
McVol	186.900	ml/mol	McGowan Calculated Property
Pc	2850.52	kPa	Joback Calculated Property
Inp	[2123.00; 2123.00]
Inp	2123.00		NIST
Inp	2123.00		NIST
Tboil	761.19	K	Joback Calculated Property
Tc	1001.85	K	Joback Calculated Property
Tfus	498.00	K	Joback Calculated Property
Vc	0.697	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[452.47; 505.12]	J/mol×K	[761.19; 1001.85]
Cp,gas	452.47	J/mol×K	761.19	Joback Calculated Property
Cp,gas	463.38	J/mol×K	801.30	Joback Calculated Property
Cp,gas	473.41	J/mol×K	841.41	Joback Calculated Property
Cp,gas	482.56	J/mol×K	881.52	Joback Calculated Property
Cp,gas	490.88	J/mol×K	921.63	Joback Calculated Property
Cp,gas	498.39	J/mol×K	961.74	Joback Calculated Property
Cp,gas	505.12	J/mol×K	1001.85	Joback Calculated Property

Similar Compounds

Find more compounds similar to Acetamide, N-(2-iodo-4-methylphenyl)-2-acetoxy-.

Sources

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

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