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CS-W001157 4
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1-Oxoisoindoline-5-carbonitrile

  • CAS No. 1261869-76-4

  • Cat. No. CS-0099136
  • Molecule weight158.16
  • Purity≥98%
  • MDL No.MFCD12924852

*For research and further manufacturing use only, not for direct human use.

1-Oxoisoindoline-5-carbonitrile|CS-0099136

Structure of 1261869-76-4

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General Information

  • CAS No. 1261869-76-4
  • Cat. No. CS-0099136
  • Purity ≥98%
  • MDL No. MFCD12924852
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₆N₂O
  • Molecular Weight 158.16
  • Synonym(s) 1-oxo-2,3-dihydroisoindole-5-carbonitrile
  • SMILES N#CC1=CC2=C(C=C1)C(NC2)=O

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   52.89
  • LogP   0.80168
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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