2-(2-Isothiocyanatoethyl)pyridine

Base Information

• Chemical Name: 2-(2-Isothiocyanatoethyl)pyridine
• CAS No.: 36810-91-0
• Molecular Formula: C₈H₈N₂S
• Molecular Weight: 164.231
• ChEMBL ID: CHEMBL2178736
• DSSTox Substance ID: DTXSID701300367
• Mol file: 36810-91-0.mol

Synonyms:2-(2-isothiocyanatoethyl)pyridine;36810-91-0;PY-ITC;SCHEMBL5592428;CHEMBL2178736;DTXSID701300367;2-(2-Pyridyl)Ethyl Isothiocyanate;AKOS000212302;EN300-64692

Chemical Property of 2-(2-Isothiocyanatoethyl)pyridine

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 164.04081944
• Heavy Atom Count: 11
• Complexity: 152

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=NC(=C1)CCN=C=S

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