Chemical Properties of Benzoic acid, p-(2-iodoacetamido)-, ethyl ester (CAS 116465-51-1)

Benzoic acid, p-(2-iodoacetamido)-, ethyl ester

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InChI
InChI=1S/C11H12INO3/c1-2-16-11(15)8-3-5-9(6-4-8)13-10(14)7-12/h3-6H,2,7H2,1H3,(H,13,14)
InChI Key
TZYCRJNOEXMIEG-UHFFFAOYSA-N
Formula
C11H12INO3
SMILES
CCOC(=O)c1ccc(NC(=O)CI)cc1
Molecular Weight1
333.12
CAS
116465-51-1
Sources

Physical Properties

Property Value Unit Source
Δf -70.81 kJ/mol Joback Calculated Property
Δfgas -272.35 kJ/mol Joback Calculated Property
Δfus 31.79 kJ/mol Joback Calculated Property
Δvap 74.73 kJ/mol Joback Calculated Property
logPoct/wat 2.24 Crippen Calculated Property
Pc 2896.73 kPa Joback Calculated Property
Tboil 756.21 K Joback Calculated Property
Tc 996.12 K Joback Calculated Property
Tfus 485.48 K Joback Calculated Property
Vc 0.70 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 454.16 J/mol×K 756.21 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH3 1
=CH- (ring) 4
-I 1
=C< (ring) 2
-CH2- 2
>NH 1
>C=O (nonring) 2

Similar Compounds

Benzoic acid, p-(2-chloroacetamido)-, ethyl ester. Methyl N-acetylaminobenzoate. Benzoic acid, 4-ethylamino-, ethyl ester. Ethyl p-butylaminobenzoate. Benzoic acid, 4-isopropylamino-, isopropyl ester. Benzoic acid, 4-propylamino-, propyl ester. Deanol acetamidobenzoate. Acedoben. Benzoic acid, 4-diethylamino-, ethyl ester. Propyl p-butylaminobenzoate. Benzoic acid, 4-(ethylamino)-, methyl ester. Methyl N-trifluoroacetylaminobenzoate. Parbenate. Benzoic acid, 4-(propylamino)-, methyl ester. Butyl p-butylaminobenzoate.

Find more compounds similar to Benzoic acid, p-(2-iodoacetamido)-, ethyl ester.

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