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Home >> Chemical Listing >> Page 2894 >> 4-Chloro-1H-indole-3-carbonitrile

4-Chloro-1H-indole-3-carbonitrile
[CAS# 889942-73-8]

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Identification
Name 4-Chloro-1H-indole-3-carbonitrile
Synonyms 4-CHLORO-3-CYANOINDOLE; 4-Chloroindole-3-carbonitrile
Molecular Structure CAS#: 889942-73-8, 4-Chloro-1H-indole-3-carbonitrile
Molecular Formula C9H5ClN2
Molecular Weight 176.60
CAS Registry Number 889942-73-8
SMILES c1cc2c(c(c1)Cl)c(c[nH]2)C#N
InChI 1S/C9H5ClN2/c10-7-2-1-3-8-9(7)6(4-11)5-12-8/h1-3,5,12H
InChIKey GETNWFHVVSHRPS-UHFFFAOYSA-N
Properties
Density 1.411g/cm3 (Cal.)
Boiling point 383.825°C at 760 mmHg (Cal.)
Flash point 185.931°C (Cal.)
Refractive index 1.686 (Cal.)
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