Dodecyl cyanoacetate

Base Information

• Chemical Name: Dodecyl cyanoacetate
• CAS No.: 60180-50-9
• Molecular Formula: C15H27NO2
• Molecular Weight: 253.38000
• DSSTox Substance ID: DTXSID80504192
• Nikkaji Number: J2.939.461J
• Wikidata: Q82358509

Synonyms:Dodecyl cyanoacetate;60180-50-9;Cyanoacetic acid, dodecyl ester;SCHEMBL1960319;DTXSID80504192;RYFZYSKTNJAFQD-UHFFFAOYSA-N

Chemical Property of Dodecyl cyanoacetate

Chemical Property:

• PSA: 50.09000
• LogP: 4.36418
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 13
• Exact Mass: 253.204179104
• Heavy Atom Count: 18
• Complexity: 242

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCOC(=O)CC#N

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