Carbonisothiocyanate, 2-propen-1-yl ester

Base Information

• Chemical Name: Carbonisothiocyanate, 2-propen-1-yl ester
• CAS No.: 55489-61-7
• Molecular Formula: C₅H₅NO₂S
• Molecular Weight: 143.166
• DSSTox Substance ID: DTXSID801271961

Synonyms:55489-61-7;Carbonisothiocyanate, 2-propen-1-yl ester;SCHEMBL1286490;DTXSID801271961

Chemical Property of Carbonisothiocyanate, 2-propen-1-yl ester

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 143.00409958
• Heavy Atom Count: 9
• Complexity: 160

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MSDS Files:

Useful:

• Canonical SMILES: C=CCOC(=O)N=C=S

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