N-(1-benzothiophen-5-yl)acetamide

Base Information

• Chemical Name: N-(1-benzothiophen-5-yl)acetamide
• CAS No.: 18044-91-2
• Molecular Formula: C₁₀H₉NOS
• Molecular Weight: 191.254
• DSSTox Substance ID: DTXSID70391114
• Nikkaji Number: J82.710J
• Wikidata: Q82188357
• ChEMBL ID: CHEMBL1705086
• Mol file: 18044-91-2.mol

Synonyms:N-(1-benzothiophen-5-yl)acetamide;18044-91-2;5-(Acetylamino)benzo[b]thiophene;MLS000624495;CHEMBL1705086;DTXSID70391114;HMS2727A14;AKOS009101966;SMR000323439

Chemical Property of N-(1-benzothiophen-5-yl)acetamide

Chemical Property:

• Melting Point: 96-98 °C
• Boiling Point: 421.4±18.0 °C(Predicted)
• PKA: 14.96±0.43(Predicted)
• Density: 1.308±0.06 g/cm3(Predicted)
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 191.04048508
• Heavy Atom Count: 13
• Complexity: 207

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=CC2=C(C=C1)SC=C2