Methyl 4-isocyanatobutanoate

Base Information

• Chemical Name: Methyl 4-isocyanatobutanoate
• CAS No.: 27678-30-4
• Molecular Formula: C6H9NO3
• Molecular Weight: 143.142
• European Community (EC) Number: 859-629-1
• DSSTox Substance ID: DTXSID60374779
• Nikkaji Number: J674.840F
• Mol file: 27678-30-4.mol

Synonyms:methyl 4-isocyanatobutanoate;27678-30-4;4-Isocyanato-butyric acid methyl ester;methyl4-isocyanatobutanoate;methyl 4-isocyanato-butyrate;SCHEMBL3403179;DTXSID60374779;RFJYIMHSDXFLQF-UHFFFAOYSA-N;CBA67830;4-isocyanatobutyric acid methyl ester;4-Isocyanatobutanoic acid methyl ester;AKOS006230550;FT-0723525;EN300-125843;F8880-0122

Chemical Property of Methyl 4-isocyanatobutanoate

Chemical Property:

• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 143.058243149
• Heavy Atom Count: 10
• Complexity: 149

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CCCN=C=O

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