3-Chloro-2-methylpropanoyl isocyanate

Base Information

• Chemical Name: 3-Chloro-2-methylpropanoyl isocyanate
• CAS No.: 25088-54-4
• Molecular Formula: C₅H₆ClNO₂
• Molecular Weight: 147.561
• DSSTox Substance ID: DTXSID90548885
• Mol file: 25088-54-4.mol

Synonyms:3-Chloro-2-methylpropanoyl isocyanate;25088-54-4;beta-chloroisobutyryl isocyanate;SCHEMBL9413210;DTXSID90548885;NOOWUUGMUCRQEQ-UHFFFAOYSA-N;AKOS006374827;alpha-methyl-beta-chloropropionyl isocyanate

Chemical Property of 3-Chloro-2-methylpropanoyl isocyanate

Chemical Property:

• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 147.0087061
• Heavy Atom Count: 9
• Complexity: 151

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CCl)C(=O)N=C=O

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