ChemicalBook--->CAS DataBase List--->13754-86-4

13754-86-4

13754-86-4 Structure

13754-86-4 Structure
IdentificationMore
[Name]

1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONE
[CAS]

13754-86-4
[Synonyms]

1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONE
1,5,6,7-TETRAHYDRO-4H-INDOLE-4-ONE
1,5,6,7-TETRAHYDRO-INDOL-4-ONE
4-OXO-4,5,6,7-TETRAHYDROINDOLE
4-Oxo-1,5,6,7-tetrahydroindole
Tetrahydroindolone
4-0xo-4,5,6,7-tetrahydroindole
1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONE 97+%
4,5,6,7-Tetrahydro-1H-indol-4-one
[Molecular Formula]

C8H9NO
[MDL Number]

MFCD00075438
[Molecular Weight]

135.16
[MOL File]

13754-86-4.mol
Chemical PropertiesBack Directory
[Melting point ]

188-190 °C (lit.)
[Boiling point ]

311℃
[density ]

1.216
[Fp ]

150℃
[storage temp. ]

Keep in dark place,Inert atmosphere,2-8°C
[pka]

15.91±0.20(Predicted)
[CAS DataBase Reference]

13754-86-4(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Resorcinol-->Ethyl bromopyruvate
Hazard InformationBack Directory
[Uses]

• ;Reactant in synthesis of psammopemmin A as antitumor agent1• ;Reactant in synthesis of a 1,3,4,5-tetrahydrobenzindole β-ketoesters and tricyclic tetrahydrobenzindoles via C-H insertion reactions2• ;Reactant in preparation of tricyclic indole and dihydroindole derivatives as inhibitors of guanylate cyclase3• ;Reactant in preparation of condensed pyrroloindoles via Pd-catalyzed intramolecular C-H bond functionalization of (halobenzyl)pyrroles4• ;Reactant in enantioselective preparation of arylalkenyl indoles via asymmetric C-H insertion of rhodium carbenoids foll
[General Description]

Iodination of 1,5,6,7-tetrahydro-4H-indol-4-one using 1-chloromethyl--4-fluoro-1,4-diazoniabicyclo[2.2.2]octane bis(tetra-fluoroborate) yields α-iodo derivative as the main product.
Spectrum DetailBack Directory
[Spectrum Detail]

1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONE(13754-86-4)MS
1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONE(13754-86-4)1HNMR
1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONE(13754-86-4)13CNMR
1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONE(13754-86-4)IR1
1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONE(13754-86-4)IR2
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

13754-86-4(sigmaaldrich)
[TCI AMERICA]

1,5,6,7-Tetrahydro-4H-indol-4-one,>97.0%(GC)(13754-86-4)
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