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[ CAS No. 10388-19-9 ]

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Cat. No.: {[proInfo.prAm]}
2D
Chemical Structure| 10388-19-9
Chemical Structure| 10388-19-9
Structure of 10388-19-9 *Storage: {[proInfo.prStorage]}

Quality Control of [ 10388-19-9 ]

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Product Details of [ 10388-19-9 ]

CAS No. :10388-19-9MDL No. :MFCD00143169
Formula : C7H6INO Boiling Point : 322.5°C at 760 mmHg
Linear Structure Formula :-InChI Key :-
M.W :247.03Pubchem ID :-
Synonyms :

Computed Properties of [ 10388-19-9 ]

TPSA : - H-Bond Acceptor Count : -
XLogP3 : - H-Bond Donor Count : -
SP3 : - Rotatable Bond Count : -

Safety of [ 10388-19-9 ]

Signal Word:WarningClass:N/A
Precautionary Statements:P261-P305+P351+P338UN#:N/A
Hazard Statements:H315-H319-H335Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 10388-19-9 ]

  • Upstream synthesis route of [ 10388-19-9 ]
  • Downstream synthetic route of [ 10388-19-9 ]

[ 10388-19-9 ] Synthesis Path-Upstream   1~1

  • 1
  • [ 10388-19-9 ]
  • [ 4481-28-1 ]
YieldReaction ConditionsOperation in experiment
87% With triethylamine In water; ethyl acetate; acetonitrile B.
3-Carboxybenzamide
A mixture of 3-iodobenzamide (4.28 g, 17.3 mmol), water (25.00 g, 1387.7 mmol), triethylamine (8.00 g, 79.1 mmol), palladium(II) acetate (0.28 g, 1.2 mmol), and bis(diphenylphosphino)propane (0.52 g, 1.3 mmol) in acetonitrile (50 mL) was pressurized to 40 psi with carbon monoxide and the pressure was released.
After six such cycles, the bottle was pressurized again and the contents were stirred at 85° C. for 3 h.
The reaction mixture was cooled to room temperature and depressurized.
The solvent was evaporated and ethyl acetate (200 mL) was added.
The solution was filtered and then extracted with water (2*200 mL).
The combined aqueous layers were acidified with 12 M HCl to pH 0.
The solid was filtered off and air-dried to give 3-carboxybenzamide (1.93 g, 87percent) as a yellow solid
Reference: [1] Patent: US6331640, 2001, B1,
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