Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate

Base Information

• Chemical Name: Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate
• CAS No.: 5471-21-6
• Molecular Formula: C7H9 N O6
• Molecular Weight: 203.15
• DSSTox Substance ID: DTXSID30366025
• Wikidata: Q82151076
• Mol file: 5471-21-6.mol

Synonyms:Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate;CCG-8610;CBMicro_020882;DTXSID30366025;(5-Phenyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid pentyl ester;STL443695;AKOS000620887;BIM-0020894.P001;SR-01000400787;SR-01000400787-1

Chemical Property of Pentyl [(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate

Chemical Property:

• Vapor Pressure: 1.08E-08mmHg at 25°C
• Boiling Point: 435.6°Cat760mmHg
• Flash Point: 217.2°C
• PSA: 113.26000
• Density: 1.22g/cm³
• LogP: -0.57650
• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 9
• Exact Mass: 306.10381361
• Heavy Atom Count: 21
• Complexity: 311

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCOC(=O)CSC1=NN=C(O1)C2=CC=CC=C2

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