ethyl 2-(7H-purin-6-ylsulfanyl)acetate

Base Information

• Chemical Name: ethyl 2-(7H-purin-6-ylsulfanyl)acetate
• CAS No.: 6941-72-6
• Molecular Formula: C₉H₁₀N₄O₂S
• Molecular Weight: 238.27
• NSC Number: 20092
• DSSTox Substance ID: DTXSID10350068
• Wikidata: Q82125804
• ChEMBL ID: CHEMBL397432

Synonyms:6941-72-6;ethyl 2-(7H-purin-6-ylsulfanyl)acetate;CHEMBL397432;IFLab1_001360;SCHEMBL10379466;6-(alpha-ethylacetatethio)purine;DTXSID10350068;HMS1415N18;NSC20092;NSC-20092;STK759941;AKOS000809378;ethyl (9H-purin-6-ylsulfanyl)acetate;IDI1_009227;ethyl 2-((9H-purin-6-yl)thio)acetate;ethyl 2-(9H-purin-6-ylsulfanyl)acetate;EU-0018631;AB00684206-01;SR-01000523775;SR-01000523775-1;F0365-0030

Chemical Property of ethyl 2-(7H-purin-6-ylsulfanyl)acetate

Chemical Property:

• Vapor Pressure: 1.77E-05mmHg at 25°C
• Boiling Point: 363.7°Cat760mmHg
• Flash Point: 173.8°C
• Density: 1.51g/cm³
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 238.05244675
• Heavy Atom Count: 16
• Complexity: 254

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CSC1=NC=NC2=C1NC=N2

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