Methyl 2-isocyanohexanoate

Base Information

• Chemical Name: Methyl 2-isocyanohexanoate
• CAS No.: 730964-70-2
• Molecular Formula: C8H13NO2
• Molecular Weight: 155.19
• Hs Code.: 2926909090
• DSSTox Substance ID: DTXSID801276109
• Mol file: 730964-70-2.mol

Synonyms:Methyl 2-isocyanohexanoate;2-Isocyanohexanoic acid methyl ester;730964-70-2;DTXSID801276109;AKOS006292675;Hexanoic acid, 2-isocyano-, methyl ester

Chemical Property of Methyl 2-isocyanohexanoate

Chemical Property:

• PSA: 26.30000
• LogP: 0.86820
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 155.094628657
• Heavy Atom Count: 11
• Complexity: 168

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(C(=O)OC)[N+]#[C-]

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