93982-50-4 Purity
96%
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Specification
The molecular formula is C21H37NO.
The molecular weight is 319.5 g/mol.
The IUPAC name is 2-hexadecoxypyridine.
The InChI is InChI=1S/C21H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-23-21-18-15-16-19-22-21/h15-16,18-19H,2-14,17,20H2,1H3.
The InChIKey is KEPLGVIQZKUMPL-UHFFFAOYSA-N.
The canonical SMILES is CCCCCCCCCCCCCCCCOC1=CC=CC=N1.
The CAS number is 93982-58-2.
The European Community (EC) number is 301-246-4.
The DSSTox Substance ID is DTXSID80240144.
The XLogP3 value is 9.2.