Chemical Properties of 3-Acetamido-2,4,6-triiodobenzoic acid (CAS 85-36-9)

3-Acetamido-2,4,6-triiodobenzoic acid

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InChI
InChI=1S/C9H6I3NO3/c1-3(14)13-8-5(11)2-4(10)6(7(8)12)9(15)16/h2H,1H3,(H,13,14)(H,15,16)
InChI Key
GNOGSFBXBWBTIG-UHFFFAOYSA-N
Formula
C9H6I3NO3
SMILES
CC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I
Molecular Weight1
556.86
CAS
85-36-9
Other Names
  • Acetrizoic acid
  • 3-Acetamino-2,4,6-triiodobenzoic acid
  • Benzoic acid, 3-(acetylamino)-2,4,6-triiodo-
  • Benzoic acid, 3-acetamido-2,4,6-triiodo-
  • 3-(Acetylamino)-2,4,6-triiodobenzoic acid
  • Acido 3-acetilamino-2,4,6-triiodobenzoico
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Physical Properties

Property Value Unit Source
ΔfG° -32.12 kJ/mol Joback Calculated Property
ΔfH°gas -131.75 kJ/mol Joback Calculated Property
ΔfusH° 37.15 kJ/mol Joback Calculated Property
ΔvapH° 105.28 kJ/mol Joback Calculated Property
log10WS -5.18 Crippen Calculated Property
logPoct/wat 3.157 Crippen Calculated Property
McVol 210.360 ml/mol McGowan Calculated Property
Pc 3690.97 kPa Joback Calculated Property
Tboil 981.43 K Joback Calculated Property
Tc 1256.31 K Joback Calculated Property
Tfus 655.21 K Joback Calculated Property
Vc 0.761 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [411.90; 440.48] J/mol×K [981.43; 1256.31] Show Hide
Cp,gas 411.90 J/mol×K 981.43 Joback Calculated Property
Cp,gas 417.14 J/mol×K 1027.24 Joback Calculated Property
Cp,gas 422.08 J/mol×K 1073.06 Joback Calculated Property
Cp,gas 426.80 J/mol×K 1118.87 Joback Calculated Property
Cp,gas 431.39 J/mol×K 1164.69 Joback Calculated Property
Cp,gas 435.92 J/mol×K 1210.50 Joback Calculated Property
Cp,gas 440.48 J/mol×K 1256.31 Joback Calculated Property

Similar Compounds

Diatrizoic acid. Uridine, 3'-O-TBDMS. Uridine, 2',3'-bis-O-TBDMS. Uridine, 2',5'-bis-O-TBDMS, 3'-O-TMS. 2',3'-Bis-(trimethylsiloxy)-5'-(tert-butyldimethylsiloxy)-uridine. Uridine, 5-methyl-. Uridine, 2',3'-bis-O-TBDMS, 5'-O-TMS. O,O,O-Tris(tert-butyldimethylsilyl)uridine. Uridine, 3',5'-bis-O-TBDMS. Uridine, 2'-O-TBDMS, 3',5'-bis-O-TMS. Uridine, 2'-O-TMS, 3',5'-bis-TBDMS. 2',5'-Bis-(trimethylsiloxy)-3'-(tert-butyldimethylsiloxy)-uridine. 2-Naphthanilide, 3'-chloro-4-[4-diethylamino-o-tolylimino]-1,4-dihydro-1-oxo-. Uridine, 2',3',5'-tris(O-TBDMSi). Uridine, 2',3',5'-tris-O-(trimethylsilyl)-.

Find more compounds similar to 3-Acetamido-2,4,6-triiodobenzoic acid.

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