1H-indole-2-thiol

Base Information

• Chemical Name: 1H-indole-2-thiol
• CAS No.: 53497-58-8
• Deprecated CAS: 496-30-0
• Molecular Formula: C8H7NS
• UNII: S9SC88MKF6
• DSSTox Substance ID: DTXSID50555116
• Wikidata: Q4596893
• Wikipedia: 2-Mercaptoindole
• Mol file: 53497-58-8.mol

Synonyms:1H-indole-2-thiol;2-Mercaptoindole;Benzazoline-2-thione;53497-58-8;Indole-2(3H)-thione;S9SC88MKF6;2H-Indole-2-thione, 1,3-dihydro-;mercaptobenzazole;UNII-S9SC88MKF6;SCHEMBL223071;SCHEMBL595727;DTXSID50555116;FVRYCPZDHKLBNR-UHFFFAOYSA-N;Q4596893

Chemical Property of 1H-indole-2-thiol

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 149.02992040
• Heavy Atom Count: 10
• Complexity: 126

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=C(N2)S