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1256584-75-4

Name tert-butyl 6-cyano-2-(2-(4-ethyl-3-iodophenyl)propan-2-yl)-1H-indole-3-carboxylate
CAS 1256584-75-4
Molecular Formula C25H27IN2O2
MDL Number MFCD22571223
Molecular Weight 514.399
MOL File 1256584-75-4.mol
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Chemical Properties

Boiling point  609.3±55.0 °C(Predicted)
density  1.43±0.1 g/cm3(Predicted)
pka 14.00±0.30(Predicted)
InChI InChI=1S/C25H27IN2O2/c1-7-16-9-10-17(13-19(16)26)25(5,6)22-21(23(29)30-24(2,3)4)18-11-8-15(14-27)12-20(18)28-22/h8-13,28H,7H2,1-6H3
InChIKey QJJFMODIDDQXRV-UHFFFAOYSA-N
SMILES N1C2=C(C=CC(C#N)=C2)C(C(OC(C)(C)C)=O)=C1C(C1=CC=C(CC)C(I)=C1)(C)C

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

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