4-Methyl-1-(piperidin-1-yl)pentane-1-thione

Base Information

• Chemical Name: 4-Methyl-1-(piperidin-1-yl)pentane-1-thione
• CAS No.: 289677-13-0
• Molecular Formula: C11H21NS
• Molecular Weight: 199.36
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID90375032
• Wikidata: Q82163578
• Mol file: 289677-13-0.mol

Synonyms:289677-13-0;4-Methyl-1-(piperidin-1-yl)pentane-1-thione;4-Methyl valeryl piperidine thioamide;4-methyl-1-piperidin-1-ylpentane-1-thione;4-Methylvalerylpiperidinethioamide;DTXSID90375032;MFCD02179413;AKOS006345221;AB11100;AS-39062;CS-0171949

Chemical Property of 4-Methyl-1-(piperidin-1-yl)pentane-1-thione

Chemical Property:

• Vapor Pressure: 0.00652mmHg at 25°C
• Refractive Index: 1.518
• Boiling Point: 271.2 °C at 760 mmHg
• PKA: 1.73±0.20(Predicted)
• Flash Point: 117.8 °C
• PSA: 35.33000
• Density: 0.981 g/cm³
• LogP: 3.17380
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 199.13947085
• Heavy Atom Count: 13
• Complexity: 160

Purity/Quality:

97% ^*data from raw suppliers

4-Methyl-1-(piperidin-1-yl)pentane-1-thione ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CCC(=S)N1CCCCC1

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