Chemical Properties of Benorilate (CAS 5003-48-5)

Benorilate

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InChI
InChI=1S/C17H15NO5/c1-11(19)18-13-7-9-14(10-8-13)23-17(21)15-5-3-4-6-16(15)22-12(2)20/h3-10H,1-2H3,(H,18,19)
InChI Key
FEJKLNWAOXSSNR-UHFFFAOYSA-N
Formula
C17H15NO5
SMILES
CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(C)=O)cc1
Molecular Weight1
313.30
CAS
5003-48-5
Other Names
  • Benzoic acid, 2-(acetyloxy)-, 4-(acetylamino)phenyl ester
  • Salicylic acid, acetate, ester with 4'-hydroxyacetanilide
  • 4'-(Acetamido)phenyl-2-acetoxybenzoate
  • p-Acetamidophenyl acetylsalicylate
  • 2-Acetoxy-4'-(acetamino)phenylbenzoate
  • p-N-Acetylaminophenylacetylsalicylate
  • 2-(Acetyloxy)benzoic acid 4-(acetylamino)phenyl ester
  • Aspirin acetaminophen ester
  • Benoral
  • Benorilato
  • Benortan
  • Benorylate
  • Fenasparate
  • Salipran
  • TO 125
  • WIN 11450
  • 4-Acetamidophenyl salicylate acetate
  • Fenasprate
  • Quinexin
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Physical Properties

Property Value Unit Source
Δf -209.55 kJ/mol Joback Calculated Property
Δfgas -492.80 kJ/mol Joback Calculated Property
Δfus 39.36 kJ/mol Joback Calculated Property
Δvap 90.81 kJ/mol Joback Calculated Property
log10WS -4.07 Crippen Calculated Property
logPoct/wat 2.789 Crippen Calculated Property
McVol 229.300 ml/mol McGowan Calculated Property
Pc 2379.54 kPa Joback Calculated Property
Tboil 908.30 K Joback Calculated Property
Tc 1145.45 K Joback Calculated Property
Tfus 606.14 K Joback Calculated Property
Vc 0.861 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [671.83; 715.92] J/mol×K [908.30; 1145.45] Show Hide
Cp,gas 671.83 J/mol×K 908.30 Joback Calculated Property
Cp,gas 682.32 J/mol×K 947.82 Joback Calculated Property
Cp,gas 691.51 J/mol×K 987.35 Joback Calculated Property
Cp,gas 699.45 J/mol×K 1026.87 Joback Calculated Property
Cp,gas 706.15 J/mol×K 1066.40 Joback Calculated Property
Cp,gas 711.63 J/mol×K 1105.92 Joback Calculated Property
Cp,gas 715.92 J/mol×K 1145.45 Joback Calculated Property

Similar Compounds

Clorazepate M (hydroxy-), isomer 1, hydrolysis, acetylated. Nordazepam M (hydroxymethoxy-), hydrolysis, acetylated. Clorazepate M (hydroxymethoxy-), hydrolysis, acetylated. Clomipramine M(HO), acetylated, isomer # 2. Acebutolol. Lycoramine. Clomipramine M(Nor-HO), diacetylated. «delta»1-tetrahydrocannabinolic acid, phenyl-boronate. Shinflavanone. cannabidiolic acid, phenyl-boronate. «DELTA»8-Tetrahydrocannabinol. Acebutolol hydrolysed, acetylated. 12-O-Methylcarnosol. narwedine. 9,10-Dihydrophenanthrene-cis-9,10-diol, ferrocenylboronate.

Find more compounds similar to Benorilate.

Sources

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