CAS
14444-77-0 Purity
>97.0%(GC)
14444-77-0 Purity
>97.0%(GC)
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Specification
The molecular formula is C8H15NO2.
The molecular weight is 157.21 g/mol.
The IUPAC name is 4,4-diethoxybutanenitrile.
The InChI is InChI=1S/C8H15NO2/c1-3-10-8(11-4-2)6-5-7-9/h8H,3-6H2,1-2H3.
The InChIKey is DRZCPHGVEATLFR-UHFFFAOYSA-N.
The canonical SMILES is CCOC(CCC#N)OCC.
The CAS number is 18381-45-8.
The European Community (EC) number is 242-263-6.
The DSSTox Substance ID is DTXSID20171483.
Yes, it is a canonicalized compound.