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Home >> Chemical Listing >> Page 3112 >> 2-tert-butyl-5-nitro-1H-indole-7-carbonitrile

2-tert-butyl-5-nitro-1H-indole-7-carbonitrile
[CAS# 952664-97-0]

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CAS#: 952664-97-0
Product: 2-tert-butyl-5-nitro-1H-indole-7-carbonitrile
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Identification
Name 2-tert-butyl-5-nitro-1H-indole-7-carbonitrile
Synonyms 2-tert-butyl-5-nitro-1H-indole-7-carbonitrile
Molecular Formula C13H13N3O2
Molecular Weight 243.26
CAS Registry Number 952664-97-0
SMILES CC(C)(C)c1cc2cc(cc(c2[nH]1)C#N)[N+](=O)[O-]
InChI 1S/C13H13N3O2/c1-13(2,3)11-6-8-4-10(16(17)18)5-9(7-14)12(8)15-11/h4-6,15H,1-3H3
InChIKey BSJQIBDHKIHBHB-UHFFFAOYSA-N
Properties
Density 1.272g/cm3 (Cal.)
Boiling point 423.268°C at 760 mmHg (Cal.)
Flash point 209.785°C (Cal.)
Refractive index 1.622 (Cal.)
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