1,4-Benzothiazepin-3(2H)-one, 4,5-dihydro-

Base Information

• Chemical Name: 1,4-Benzothiazepin-3(2H)-one, 4,5-dihydro-
• CAS No.: 103693-32-9
• Molecular Formula: C₉H₉NOS
• Molecular Weight: 179.243
• DSSTox Substance ID: DTXSID70400336
• Nikkaji Number: J3.231.910F
• Wikidata: Q82203258
• Mol file: 103693-32-9.mol

Synonyms:4,5-Dihydro-1,4-benzothiazepin-3(2H)-one;1,4-Benzothiazepin-3(2H)-one, 4,5-dihydro-;103693-32-9;SCHEMBL8526616;DTXSID70400336;ZBJVPBPXJSMVLG-UHFFFAOYSA-N;4,5-Dihydro-1,4-benzothiazepine-3(2H)-one

Chemical Property of 1,4-Benzothiazepin-3(2H)-one, 4,5-dihydro-

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 179.04048508
• Heavy Atom Count: 12
• Complexity: 183

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2=CC=CC=C2SCC(=O)N1