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Home > Encyclopedia > 1H-indol-3-yl thiocyanate

1H-indol-3-yl thiocyanate

1H-indol-3-yl thiocyanate structure

1H-indol-3-yl thiocyanate 

structure
  • CAS No:

    23706-25-4

  • Formula:

    C9H6N2S

  • Chemical Name:

    1H-indol-3-yl thiocyanate

  • Synonyms:

    3-Thiocyanatoindole;1H-Indol-3-yl thiocyanate;23706-25-4;Thiocyanic acid, 1H-indol-3-yl ester;Thiocyanic acid, indol-3-yl ester;3-thiocyano indole;NSC144993;3-Thiocyanato-1H-indole;1H-Indol-3-yl thiocyanate #;CHEMBL3824283;SCHEMBL16789820;DTXSID80301623;ZINC1728128;NSC-144993

1H-indol-3-yl thiocyanate Basic Attributes

174.22 g/mol

174.02516937 g/mol

144993

DTXSID80301623

Characteristics

64.9 Ų

Computed Properties

Molecular Weight:174.22
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:174.02516937
Monoisotopic Mass:174.02516937
Topological Polar Surface Area:64.9
Heavy Atom Count:12
Complexity:208
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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