S-[2-(3-fluoroanilino)-2-oxoethyl] carbamothioate

Base Information

• Chemical Name: S-[2-(3-fluoroanilino)-2-oxoethyl] carbamothioate
• CAS No.: 5949-71-3
• Molecular Formula: C9H9FN2O2S
• Molecular Weight: 228.2434
• DSSTox Substance ID: DTXSID60417251
• Wikidata: Q82227026

Synonyms:S-[2-(3-fluoroanilino)-2-oxoethyl] carbamothioate;5949-71-3;CBMicro_009913;Oprea1_614495;SCHEMBL12127471;DTXSID60417251;SMSF0010498;CB12776;BIM-0009799.P001

Chemical Property of S-[2-(3-fluoroanilino)-2-oxoethyl] carbamothioate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.444g/cm³
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 228.03687687
• Heavy Atom Count: 15
• Complexity: 250

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)F)NC(=O)CSC(=O)N

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