Chemical Properties of Benoxinate (CAS 99-43-4)


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InChI Key
Molecular Weight1
Other Names
  • 2-(Diethylamino)ethyl 4-amino-3-butoxybenzoate
  • 4-Amino-3-butoxybenzoic acid 2-diethylaminoethyl ester
  • 4-Amino-3-n-butoxy-benzoesaeure-diaethylaminoaethylester
  • Benoxil
  • Benoxinate
  • Conjucain
  • Dorsacain
  • Novesinol
  • Oxibuprokain
  • Oxybucaine
  • Oxybuprocaine
  • Oxyriprocaine
  • Prescaina
  • S 749

Physical Properties

Property Value Unit Source
Δf 23.72 kJ/mol Joback Calculated Property
Δfgas -456.32 kJ/mol Joback Calculated Property
Δfus 45.24 kJ/mol Joback Calculated Property
Δvap 81.29 kJ/mol Joback Calculated Property
logPoct/wat 2.95 Crippen Calculated Property
Pc 1645.76 kPa Joback Calculated Property
Tboil 808.68 K Joback Calculated Property
Tc 1010.19 K Joback Calculated Property
Tfus 542.93 K Joback Calculated Property
Vc 0.97 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 795.30 J/mol×K 808.68 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 1
=CH- (ring) 3
-CH2- 7
-NH2 1
=C< (ring) 3
>N- 1
-CH3 3

Similar Compounds

Benoxinate hydrochloride. Ophthaine. Benzoic acid, 3-butyloxy-, butyl ester. Benzoic acid, 3-(3-methylbutyl)oxy-, 3-methylbutyl ester. Benzoic acid, 3-propyloxy-, propyl ester. Benzoic acid, 3-(2-methylbutyl)oxy-, 2-methylbutyl ester. Benzoic acid, 3-pentyloxy-, pentyl ester. Benzoic acid, 3-(2-methylpropyl)oxy-, 2-methylpropyl ester. Benzoic acid, 3-butyloxy-, methyl ester. Benzoic acid, 3-ethyloxy-, ethyl ester. Benzoic acid, 3-(2-methylbutyl)oxy-, methyl ester. Benzoic acid, 3-(3-methylbutyl)oxy-, methyl ester. Benzoic acid, 3-pentyloxy-, methyl ester. Benzoic acid, 4-amino-2-propoxy-, 2-(diethylamino)ethyl ester. Methyl 3-methoxy-4-nitrobenzoate.

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