1-Isocyanatopropadiene

Base Information

• Chemical Name: 1-Isocyanatopropadiene
• CAS No.: 141461-91-8
• Molecular Formula: C4H3NO
• DSSTox Substance ID: DTXSID00576917
• Nikkaji Number: J3.046.425G
• Mol file: 141461-91-8.mol

Synonyms:1-Isocyanatopropadiene;141461-91-8;DTXSID00576917

Chemical Property of 1-Isocyanatopropadiene

Chemical Property:

• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 81.021463719
• Heavy Atom Count: 6
• Complexity: 116

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=C=CN=C=O

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