Methyl 2-[(3-pyridylmethyl)thio]acetate

Base Information

• Chemical Name: Methyl 2-[(3-pyridylmethyl)thio]acetate
• CAS No.: 306935-34-2
• Molecular Formula: C9H11 N O2 S
• Molecular Weight: 197.25414
• DSSTox Substance ID: DTXSID30371715
• Wikidata: Q82159152
• Mol file: 306935-34-2.mol

Synonyms:306935-34-2;methyl 2-[(3-pyridylmethyl)thio]acetate;Methyl 2-(3-picolylthio)acetate;methyl 2-(pyridin-3-ylmethylsulfanyl)acetate;Acetic acid, 2-[(3-pyridinylmethyl)thio]-, methyl ester;DTXSID30371715;methyl 2-(pyridin-3-ylmethylthio)acetate;FT-0628424;Methyl {[(pyridin-3-yl)methyl]sulfanyl}acetate

Chemical Property of Methyl 2-[(3-pyridylmethyl)thio]acetate

Chemical Property:

• Vapor Pressure: 0.000976mmHg at 25°C
• Refractive Index: 1.55
• Boiling Point: 302.7°C at 760 mmHg
• Flash Point: 136.8°C
• PSA: 64.49000
• Density: 1.188g/cm³
• LogP: 1.48780
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 197.05104977
• Heavy Atom Count: 13
• Complexity: 164

Purity/Quality:

95% ^*data from raw suppliers

METHYL 2-[(3-PYRIDYLMETHYL)THIO]ACETATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CSCC1=CN=CC=C1

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