1,4-Thiazepane

Base Information

• Chemical Name: 1,4-Thiazepane
• CAS No.: 101184-85-4
• Molecular Formula: C5H11NS
• Molecular Weight: 117.215
• DSSTox Substance ID: DTXSID30586342
• Wikidata: Q82478452
• Mol file: 101184-85-4.mol

Synonyms:1,4-thiazepane;101184-85-4;1,4-Thiazepine, hexahydro-;hexahydro-1,4-thiazepine;perhydro-1,4-thiazepine;SCHEMBL138572;DTXSID30586342;OQFUNFPIPRUQAE-UHFFFAOYSA-N;AKOS006220752;MCULE-3091366568;DB-297633;EN300-54917;F2147-1370;Z1954803255

Chemical Property of 1,4-Thiazepane

Chemical Property:

• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 117.06122053
• Heavy Atom Count: 7
• Complexity: 47.3

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNCCSC1

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