4,4-difluorobut-2-ynoic Acid

Base Information

• Chemical Name: 4,4-difluorobut-2-ynoic Acid
• CAS No.: 110680-65-4
• Molecular Formula: C4H2F2O2
• Molecular Weight: 120.05400
• European Community (EC) Number: 890-103-4
• DSSTox Substance ID: DTXSID20472987
• Nikkaji Number: J232.153J
• Wikidata: Q82302173

Synonyms:4,4-difluorobut-2-ynoic Acid;110680-65-4;2-Butynoic acid, 4,4-difluoro-;DTXSID20472987;LDPYBCPZBJVBAB-UHFFFAOYSA-N;AKOS006380907;EN300-787392

Chemical Property of 4,4-difluorobut-2-ynoic Acid

Chemical Property:

• PSA: 37.30000
• LogP: 0.33950
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 120.00228563
• Heavy Atom Count: 8
• Complexity: 150

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(#CC(=O)O)C(F)F

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